NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
473579 |
2k0m   |
15652 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k0m
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1758
_Distance_constraint_stats_list.Viol_count 444
_Distance_constraint_stats_list.Viol_total 319.264
_Distance_constraint_stats_list.Viol_max 0.250
_Distance_constraint_stats_list.Viol_rms 0.0060
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0360
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 PRO 0.051 0.025 9 0 "[ . 1 . 2]"
1 7 ILE 0.182 0.036 12 0 "[ . 1 . 2]"
1 8 GLU 0.003 0.003 13 0 "[ . 1 . 2]"
1 9 ILE 0.043 0.023 15 0 "[ . 1 . 2]"
1 10 ALA 0.010 0.010 5 0 "[ . 1 . 2]"
1 11 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 HIS 0.062 0.033 14 0 "[ . 1 . 2]"
1 13 GLU 0.003 0.003 13 0 "[ . 1 . 2]"
1 14 PHE 0.302 0.060 19 0 "[ . 1 . 2]"
1 15 ALA 0.006 0.006 17 0 "[ . 1 . 2]"
1 16 ARG 0.018 0.018 14 0 "[ . 1 . 2]"
1 17 LYS 1.388 0.167 3 0 "[ . 1 . 2]"
1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ASP 0.746 0.167 3 0 "[ . 1 . 2]"
1 20 ALA 0.049 0.036 12 0 "[ . 1 . 2]"
1 21 LEU 0.463 0.117 19 0 "[ . 1 . 2]"
1 22 ALA 0.063 0.037 8 0 "[ . 1 . 2]"
1 23 PHE 0.033 0.033 14 0 "[ . 1 . 2]"
1 24 MET 1.290 0.174 2 0 "[ . 1 . 2]"
1 25 LYS 0.335 0.098 8 0 "[ . 1 . 2]"
1 26 VAL 0.561 0.127 8 0 "[ . 1 . 2]"
1 27 MET 1.198 0.174 2 0 "[ . 1 . 2]"
1 28 LEU 0.229 0.069 13 0 "[ . 1 . 2]"
1 29 ASN 1.328 0.127 8 0 "[ . 1 . 2]"
1 30 ARG 0.239 0.069 12 0 "[ . 1 . 2]"
1 31 TYR 0.201 0.048 2 0 "[ . 1 . 2]"
1 32 ARG 0.984 0.143 16 0 "[ . 1 . 2]"
1 33 PRO 1.938 0.250 15 0 "[ . 1 . 2]"
1 34 GLY 2.800 0.250 15 0 "[ . 1 . 2]"
1 35 ASP 0.085 0.033 8 0 "[ . 1 . 2]"
1 36 ILE 0.054 0.022 6 0 "[ . 1 . 2]"
1 37 VAL 0.139 0.080 14 0 "[ . 1 . 2]"
1 38 SER 0.037 0.026 7 0 "[ . 1 . 2]"
1 39 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 ASP 0.188 0.080 14 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 PHE 0.028 0.019 15 0 "[ . 1 . 2]"
1 45 LEU 0.052 0.052 20 0 "[ . 1 . 2]"
1 46 VAL 0.490 0.064 4 0 "[ . 1 . 2]"
1 47 GLU 0.029 0.029 9 0 "[ . 1 . 2]"
1 48 ALA 0.511 0.085 3 0 "[ . 1 . 2]"
1 49 LEU 0.815 0.054 1 0 "[ . 1 . 2]"
1 50 LYS 0.267 0.045 3 0 "[ . 1 . 2]"
1 51 ARG 0.095 0.024 11 0 "[ . 1 . 2]"
1 52 HIS 0.039 0.017 11 0 "[ . 1 . 2]"
1 53 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASP 0.048 0.036 12 0 "[ . 1 . 2]"
1 55 ALA 0.154 0.038 19 0 "[ . 1 . 2]"
1 56 THR 0.010 0.010 19 0 "[ . 1 . 2]"
1 57 SER 0.099 0.037 18 0 "[ . 1 . 2]"
1 58 LYS 0.120 0.036 12 0 "[ . 1 . 2]"
1 59 ILE 0.540 0.054 1 0 "[ . 1 . 2]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PRO 0.310 0.112 12 0 "[ . 1 . 2]"
1 62 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 VAL 0.262 0.064 4 0 "[ . 1 . 2]"
1 64 ARG 0.189 0.090 4 0 "[ . 1 . 2]"
1 65 ASN 0.199 0.090 4 0 "[ . 1 . 2]"
1 66 PHE 0.085 0.038 10 0 "[ . 1 . 2]"
1 67 GLU 0.022 0.022 6 0 "[ . 1 . 2]"
1 68 VAL 0.077 0.048 2 0 "[ . 1 . 2]"
1 69 ARG 0.061 0.023 7 0 "[ . 1 . 2]"
1 70 SER 0.073 0.035 4 0 "[ . 1 . 2]"
1 71 ALA 0.048 0.027 5 0 "[ . 1 . 2]"
1 72 ASP 0.262 0.084 8 0 "[ . 1 . 2]"
1 73 TYR 0.076 0.025 7 0 "[ . 1 . 2]"
1 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLN 0.963 0.084 8 0 "[ . 1 . 2]"
1 77 CYS 0.049 0.027 5 0 "[ . 1 . 2]"
1 78 PHE 0.462 0.069 13 0 "[ . 1 . 2]"
1 79 TRP 0.404 0.045 14 0 "[ . 1 . 2]"
1 80 ILE 0.241 0.108 12 0 "[ . 1 . 2]"
1 81 LEU 0.936 0.122 17 0 "[ . 1 . 2]"
1 82 ARG 0.579 0.108 12 0 "[ . 1 . 2]"
1 83 THR 0.022 0.022 5 0 "[ . 1 . 2]"
1 84 ASP 0.356 0.112 12 0 "[ . 1 . 2]"
1 85 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 SER 0.239 0.064 13 0 "[ . 1 . 2]"
1 87 GLU 1.253 0.122 17 0 "[ . 1 . 2]"
1 88 GLU 0.116 0.031 9 0 "[ . 1 . 2]"
1 89 ARG 0.226 0.045 14 0 "[ . 1 . 2]"
1 90 PHE 0.505 0.077 7 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 TYR 0.125 0.077 7 0 "[ . 1 . 2]"
1 93 LYS 0.274 0.093 8 0 "[ . 1 . 2]"
1 94 LYS 0.144 0.093 8 0 "[ . 1 . 2]"
1 95 CYS 0.872 0.115 19 0 "[ . 1 . 2]"
1 96 VAL 1.087 0.115 19 0 "[ . 1 . 2]"
1 97 LEU 1.796 0.105 9 0 "[ . 1 . 2]"
1 98 GLU 1.102 0.104 8 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LYS HA 1 3 LYS QG 3.740 . 4.300 2.691 2.109 3.451 . 0 0 "[ . 1 . 2]" 1
2 1 3 LYS HA 1 4 ALA H 3.130 . 3.600 2.762 2.168 3.433 . 0 0 "[ . 1 . 2]" 1
3 1 3 LYS QB 1 4 ALA H 4.400 . 5.060 3.150 1.897 4.042 . 0 0 "[ . 1 . 2]" 1
4 1 3 LYS HB2 1 4 ALA H 5.090 . 5.850 3.766 1.906 4.553 . 0 0 "[ . 1 . 2]" 1
5 1 3 LYS HB3 1 4 ALA H 5.090 . 5.850 3.649 1.933 4.679 . 0 0 "[ . 1 . 2]" 1
6 1 4 ALA H 1 4 ALA MB 3.070 . 3.530 2.408 2.225 2.869 . 0 0 "[ . 1 . 2]" 1
7 1 4 ALA HA 1 5 GLN H 2.660 . 3.060 2.347 2.164 2.998 . 0 0 "[ . 1 . 2]" 1
8 1 4 ALA HA 1 5 GLN QB 4.400 . 5.060 4.528 4.270 4.976 . 0 0 "[ . 1 . 2]" 1
9 1 4 ALA HA 1 5 GLN QG 5.340 . 6.140 4.294 3.541 5.092 . 0 0 "[ . 1 . 2]" 1
10 1 4 ALA MB 1 5 GLN H 3.490 . 4.010 3.117 1.881 3.703 . 0 0 "[ . 1 . 2]" 1
11 1 4 ALA MB 1 5 GLN QG 4.520 . 5.200 4.280 2.809 5.012 . 0 0 "[ . 1 . 2]" 1
12 1 5 GLN H 1 5 GLN QB 3.210 . 3.690 2.706 2.321 3.396 . 0 0 "[ . 1 . 2]" 1
13 1 5 GLN H 1 5 GLN QG 3.410 . 3.920 2.720 2.304 3.164 . 0 0 "[ . 1 . 2]" 1
14 1 5 GLN H 1 6 PRO QD 4.820 . 5.540 4.279 3.704 4.458 . 0 0 "[ . 1 . 2]" 1
15 1 5 GLN HA 1 5 GLN QG 3.610 . 4.150 2.743 2.377 3.508 . 0 0 "[ . 1 . 2]" 1
16 1 5 GLN HA 1 6 PRO HD2 2.830 . 3.250 2.602 2.073 2.950 . 0 0 "[ . 1 . 2]" 1
17 1 5 GLN HA 1 6 PRO QD 2.440 . 2.810 2.019 1.846 2.233 . 0 0 "[ . 1 . 2]" 1
18 1 5 GLN HA 1 6 PRO HD3 2.830 . 3.250 2.195 1.872 2.760 . 0 0 "[ . 1 . 2]" 1
19 1 5 GLN QB 1 6 PRO QD 3.570 . 4.110 2.386 1.885 3.617 . 0 0 "[ . 1 . 2]" 1
20 1 5 GLN QE 1 6 PRO QD 4.870 . 5.600 4.025 2.721 5.203 . 0 0 "[ . 1 . 2]" 1
21 1 5 GLN QG 1 6 PRO QD 3.730 . 4.290 3.506 2.919 3.998 . 0 0 "[ . 1 . 2]" 1
22 1 6 PRO HA 1 7 ILE H 2.830 . 3.250 2.298 2.164 2.519 . 0 0 "[ . 1 . 2]" 1
23 1 6 PRO HA 1 7 ILE HA 4.500 . 5.180 4.365 4.310 4.463 . 0 0 "[ . 1 . 2]" 1
24 1 6 PRO HA 1 7 ILE HB 5.070 . 5.830 4.747 4.626 4.992 . 0 0 "[ . 1 . 2]" 1
25 1 6 PRO HA 1 7 ILE MD 4.690 . 5.390 2.713 2.459 3.014 . 0 0 "[ . 1 . 2]" 1
26 1 6 PRO HA 1 14 PHE H 4.980 . 5.730 5.080 4.058 5.755 0.025 9 0 "[ . 1 . 2]" 1
27 1 6 PRO HA 1 15 ALA HA 3.680 . 4.230 3.371 2.136 4.236 0.006 17 0 "[ . 1 . 2]" 1
28 1 6 PRO HA 1 16 ARG H 5.500 . 6.330 5.180 3.883 5.878 . 0 0 "[ . 1 . 2]" 1
29 1 6 PRO QB 1 7 ILE H 3.130 . 3.600 2.943 2.335 3.582 . 0 0 "[ . 1 . 2]" 1
30 1 6 PRO QB 1 7 ILE MD 4.220 . 4.850 3.941 3.503 4.417 . 0 0 "[ . 1 . 2]" 1
31 1 6 PRO QB 1 14 PHE H 4.320 . 4.970 3.604 3.153 4.309 . 0 0 "[ . 1 . 2]" 1
32 1 6 PRO QB 1 15 ALA HA 3.590 . 4.130 2.568 1.807 3.644 . 0 0 "[ . 1 . 2]" 1
33 1 6 PRO HB2 1 7 ILE H 3.580 . 4.120 3.293 2.388 3.981 . 0 0 "[ . 1 . 2]" 1
34 1 6 PRO HB2 1 14 PHE H 5.000 . 5.750 3.864 3.236 4.682 . 0 0 "[ . 1 . 2]" 1
35 1 6 PRO HB2 1 15 ALA HA 4.400 . 5.060 3.912 2.841 4.972 . 0 0 "[ . 1 . 2]" 1
36 1 6 PRO HB3 1 7 ILE H 3.580 . 4.120 3.459 2.864 4.085 . 0 0 "[ . 1 . 2]" 1
37 1 6 PRO HB3 1 14 PHE H 5.000 . 5.750 4.584 3.362 5.446 . 0 0 "[ . 1 . 2]" 1
38 1 6 PRO HB3 1 15 ALA HA 4.400 . 5.060 2.621 1.816 3.755 . 0 0 "[ . 1 . 2]" 1
39 1 6 PRO QG 1 7 ILE H 4.540 . 5.220 4.519 3.977 5.007 . 0 0 "[ . 1 . 2]" 1
40 1 6 PRO QG 1 15 ALA HA 5.350 . 6.150 3.965 2.170 5.556 . 0 0 "[ . 1 . 2]" 1
41 1 6 PRO HG2 1 7 ILE H 5.280 . 6.070 5.094 4.178 5.680 . 0 0 "[ . 1 . 2]" 1
42 1 6 PRO HG3 1 7 ILE H 5.280 . 6.070 5.155 4.869 5.663 . 0 0 "[ . 1 . 2]" 1
43 1 7 ILE H 1 7 ILE HB 3.160 . 3.630 2.495 2.436 2.581 . 0 0 "[ . 1 . 2]" 1
44 1 7 ILE H 1 7 ILE MD 3.880 . 4.460 1.860 1.780 2.062 0.020 12 0 "[ . 1 . 2]" 1
45 1 7 ILE H 1 7 ILE HG12 4.210 . 4.840 3.932 3.874 4.092 . 0 0 "[ . 1 . 2]" 1
46 1 7 ILE H 1 7 ILE HG13 3.870 . 4.450 3.507 3.330 3.732 . 0 0 "[ . 1 . 2]" 1
47 1 7 ILE H 1 7 ILE MG 3.940 . 4.530 3.793 3.773 3.829 . 0 0 "[ . 1 . 2]" 1
48 1 7 ILE H 1 14 PHE H 3.870 . 4.450 3.497 3.042 3.884 . 0 0 "[ . 1 . 2]" 1
49 1 7 ILE H 1 14 PHE HB2 4.280 . 4.920 3.409 2.959 3.662 . 0 0 "[ . 1 . 2]" 1
50 1 7 ILE H 1 14 PHE HB3 4.730 . 5.440 4.597 4.149 4.835 . 0 0 "[ . 1 . 2]" 1
51 1 7 ILE H 1 14 PHE HD2 4.610 . 5.300 4.875 4.541 5.179 . 0 0 "[ . 1 . 2]" 1
52 1 7 ILE H 1 15 ALA HA 4.710 . 5.420 4.012 3.309 4.493 . 0 0 "[ . 1 . 2]" 1
53 1 7 ILE H 1 17 LYS HA 5.300 . 6.100 5.459 5.081 5.895 . 0 0 "[ . 1 . 2]" 1
54 1 7 ILE HA 1 7 ILE MD 3.810 . 4.380 2.993 2.820 3.171 . 0 0 "[ . 1 . 2]" 1
55 1 7 ILE HA 1 7 ILE HG12 3.880 . 4.460 3.679 3.665 3.694 . 0 0 "[ . 1 . 2]" 1
56 1 7 ILE HA 1 7 ILE HG13 3.970 . 4.570 2.448 2.423 2.487 . 0 0 "[ . 1 . 2]" 1
57 1 7 ILE HA 1 7 ILE MG 3.330 . 3.830 2.460 2.385 2.513 . 0 0 "[ . 1 . 2]" 1
58 1 7 ILE HA 1 8 GLU H 2.800 . 3.220 2.226 2.163 2.399 . 0 0 "[ . 1 . 2]" 1
59 1 7 ILE HB 1 7 ILE MD 3.110 . 3.580 2.387 2.337 2.423 . 0 0 "[ . 1 . 2]" 1
60 1 7 ILE HB 1 14 PHE H 3.820 . 4.390 3.477 3.066 4.062 . 0 0 "[ . 1 . 2]" 1
61 1 7 ILE HB 1 14 PHE HB2 3.920 . 4.510 2.080 1.776 2.578 0.024 18 0 "[ . 1 . 2]" 1
62 1 7 ILE HB 1 14 PHE HB3 4.180 . 4.810 3.605 3.307 4.297 . 0 0 "[ . 1 . 2]" 1
63 1 7 ILE HB 1 14 PHE HD2 4.290 . 4.930 3.119 2.697 3.567 . 0 0 "[ . 1 . 2]" 1
64 1 7 ILE HB 1 17 LYS H 5.500 . 6.330 5.583 4.649 6.192 . 0 0 "[ . 1 . 2]" 1
65 1 7 ILE HB 1 17 LYS HA 3.990 . 4.590 4.067 3.364 4.621 0.031 2 0 "[ . 1 . 2]" 1
66 1 7 ILE HB 1 20 ALA H 5.490 . 6.310 4.668 4.074 5.780 . 0 0 "[ . 1 . 2]" 1
67 1 7 ILE MD 1 8 GLU H 5.010 . 5.760 4.726 4.583 4.871 . 0 0 "[ . 1 . 2]" 1
68 1 7 ILE MD 1 14 PHE HB2 4.110 . 4.730 3.453 3.109 3.939 . 0 0 "[ . 1 . 2]" 1
69 1 7 ILE MD 1 14 PHE HB3 4.270 . 4.910 4.139 3.697 4.608 . 0 0 "[ . 1 . 2]" 1
70 1 7 ILE MD 1 14 PHE HD2 5.020 . 5.770 4.957 4.582 5.345 . 0 0 "[ . 1 . 2]" 1
71 1 7 ILE MD 1 17 LYS HA 3.390 . 3.900 2.892 2.347 3.311 . 0 0 "[ . 1 . 2]" 1
72 1 7 ILE MD 1 20 ALA H 5.400 . 6.210 4.673 4.261 5.229 . 0 0 "[ . 1 . 2]" 1
73 1 7 ILE MD 1 20 ALA MB 3.620 . 4.160 3.949 3.630 4.196 0.036 12 0 "[ . 1 . 2]" 1
74 1 7 ILE HG12 1 7 ILE MG 3.310 . 3.810 2.267 2.236 2.298 . 0 0 "[ . 1 . 2]" 1
75 1 7 ILE HG12 1 17 LYS HA 3.910 . 4.500 2.858 2.185 4.089 . 0 0 "[ . 1 . 2]" 1
76 1 7 ILE HG12 1 20 ALA MB 4.030 . 4.630 3.604 2.940 4.616 . 0 0 "[ . 1 . 2]" 1
77 1 7 ILE HG13 1 8 GLU H 4.730 . 5.440 4.623 4.467 4.859 . 0 0 "[ . 1 . 2]" 1
78 1 7 ILE MG 1 8 GLU H 3.340 . 3.840 3.352 3.021 3.762 . 0 0 "[ . 1 . 2]" 1
79 1 7 ILE MG 1 9 ILE H 4.700 . 5.400 3.945 3.679 4.308 . 0 0 "[ . 1 . 2]" 1
80 1 7 ILE MG 1 9 ILE MD 2.910 . 3.350 2.371 2.226 2.582 . 0 0 "[ . 1 . 2]" 1
81 1 7 ILE MG 1 9 ILE HG13 3.700 . 4.260 2.175 1.910 2.410 . 0 0 "[ . 1 . 2]" 1
82 1 7 ILE MG 1 14 PHE H 4.390 . 5.050 3.907 3.705 4.134 . 0 0 "[ . 1 . 2]" 1
83 1 7 ILE MG 1 14 PHE HB2 4.250 . 4.890 3.201 2.883 3.899 . 0 0 "[ . 1 . 2]" 1
84 1 7 ILE MG 1 14 PHE HB3 5.160 . 5.930 4.508 4.106 5.335 . 0 0 "[ . 1 . 2]" 1
85 1 7 ILE MG 1 14 PHE HD2 3.540 . 4.070 2.506 2.154 3.143 . 0 0 "[ . 1 . 2]" 1
86 1 7 ILE MG 1 17 LYS HA 4.450 . 5.120 3.939 3.355 4.896 . 0 0 "[ . 1 . 2]" 1
87 1 7 ILE MG 1 44 PHE QE 5.240 . 6.030 5.080 4.513 5.640 . 0 0 "[ . 1 . 2]" 1
88 1 7 ILE MG 1 44 PHE HZ 4.820 . 5.540 4.802 4.065 5.550 0.010 2 0 "[ . 1 . 2]" 1
89 1 8 GLU H 1 8 GLU HB2 3.380 . 3.890 2.730 2.485 2.887 . 0 0 "[ . 1 . 2]" 1
90 1 8 GLU H 1 8 GLU QB 2.960 . 3.400 2.350 2.287 2.483 . 0 0 "[ . 1 . 2]" 1
91 1 8 GLU H 1 8 GLU HB3 3.380 . 3.890 2.574 2.461 2.794 . 0 0 "[ . 1 . 2]" 1
92 1 8 GLU H 1 8 GLU QG 4.670 . 5.370 4.089 3.999 4.199 . 0 0 "[ . 1 . 2]" 1
93 1 8 GLU H 1 9 ILE HG13 4.370 . 5.030 4.242 3.876 4.488 . 0 0 "[ . 1 . 2]" 1
94 1 8 GLU HA 1 8 GLU QG 3.550 . 4.080 2.430 2.355 2.516 . 0 0 "[ . 1 . 2]" 1
95 1 8 GLU HA 1 9 ILE H 2.880 . 3.310 2.155 2.126 2.198 . 0 0 "[ . 1 . 2]" 1
96 1 8 GLU HA 1 12 HIS H 4.930 . 5.670 4.499 3.815 4.929 . 0 0 "[ . 1 . 2]" 1
97 1 8 GLU HA 1 13 GLU H 4.770 . 5.490 4.398 3.941 4.752 . 0 0 "[ . 1 . 2]" 1
98 1 8 GLU HA 1 13 GLU HA 3.890 . 4.470 2.098 1.797 2.539 0.003 13 0 "[ . 1 . 2]" 1
99 1 8 GLU HA 1 13 GLU QG 5.340 . 6.140 4.617 2.909 5.612 . 0 0 "[ . 1 . 2]" 1
100 1 8 GLU HA 1 14 PHE H 4.220 . 4.850 3.172 2.723 3.830 . 0 0 "[ . 1 . 2]" 1
101 1 8 GLU QG 1 9 ILE H 3.320 . 3.820 3.195 2.693 3.625 . 0 0 "[ . 1 . 2]" 1
102 1 8 GLU QG 1 11 GLY H 3.890 . 4.470 3.266 2.415 4.171 . 0 0 "[ . 1 . 2]" 1
103 1 8 GLU QG 1 11 GLY QA 4.790 . 5.510 3.385 2.742 4.209 . 0 0 "[ . 1 . 2]" 1
104 1 8 GLU QG 1 13 GLU HA 4.330 . 4.980 3.078 2.289 4.051 . 0 0 "[ . 1 . 2]" 1
105 1 8 GLU HG2 1 13 GLU HA 5.110 . 5.880 3.653 2.323 4.937 . 0 0 "[ . 1 . 2]" 1
106 1 8 GLU HG3 1 13 GLU HA 5.110 . 5.880 3.890 2.309 5.319 . 0 0 "[ . 1 . 2]" 1
107 1 9 ILE H 1 9 ILE HB 3.520 . 4.050 2.738 2.595 2.858 . 0 0 "[ . 1 . 2]" 1
108 1 9 ILE H 1 9 ILE MD 4.380 . 5.040 4.147 3.972 4.236 . 0 0 "[ . 1 . 2]" 1
109 1 9 ILE H 1 9 ILE HG12 4.980 . 5.730 4.001 3.821 4.112 . 0 0 "[ . 1 . 2]" 1
110 1 9 ILE H 1 9 ILE HG13 3.880 . 4.460 2.924 2.695 3.051 . 0 0 "[ . 1 . 2]" 1
111 1 9 ILE H 1 9 ILE MG 4.220 . 4.850 3.901 3.847 3.948 . 0 0 "[ . 1 . 2]" 1
112 1 9 ILE H 1 10 ALA H 4.680 . 5.380 4.165 4.003 4.313 . 0 0 "[ . 1 . 2]" 1
113 1 9 ILE H 1 11 GLY H 4.740 . 5.450 3.956 3.632 4.400 . 0 0 "[ . 1 . 2]" 1
114 1 9 ILE H 1 12 HIS H 3.500 . 4.030 3.144 2.746 3.534 . 0 0 "[ . 1 . 2]" 1
115 1 9 ILE H 1 12 HIS HB2 4.260 . 4.900 3.275 3.094 3.564 . 0 0 "[ . 1 . 2]" 1
116 1 9 ILE H 1 13 GLU H 4.970 . 5.720 4.805 4.430 4.937 . 0 0 "[ . 1 . 2]" 1
117 1 9 ILE H 1 13 GLU HA 3.950 . 4.540 3.560 3.226 3.821 . 0 0 "[ . 1 . 2]" 1
118 1 9 ILE H 1 14 PHE H 5.230 . 6.010 4.375 3.832 5.040 . 0 0 "[ . 1 . 2]" 1
119 1 9 ILE H 1 14 PHE HD2 4.410 . 5.070 3.698 3.284 4.085 . 0 0 "[ . 1 . 2]" 1
120 1 9 ILE HA 1 9 ILE MD 4.100 . 4.720 3.853 3.833 3.879 . 0 0 "[ . 1 . 2]" 1
121 1 9 ILE HA 1 9 ILE HG12 3.820 . 4.390 2.566 2.523 2.620 . 0 0 "[ . 1 . 2]" 1
122 1 9 ILE HA 1 9 ILE HG13 3.850 . 4.430 3.084 3.034 3.150 . 0 0 "[ . 1 . 2]" 1
123 1 9 ILE HA 1 9 ILE MG 3.480 . 4.000 2.404 2.358 2.434 . 0 0 "[ . 1 . 2]" 1
124 1 9 ILE HA 1 10 ALA H 3.190 . 3.670 2.169 2.152 2.189 . 0 0 "[ . 1 . 2]" 1
125 1 9 ILE HA 1 11 GLY H 4.890 . 5.620 3.935 3.766 4.345 . 0 0 "[ . 1 . 2]" 1
126 1 9 ILE HA 1 44 PHE HA 5.500 . 6.330 5.728 5.408 6.158 . 0 0 "[ . 1 . 2]" 1
127 1 9 ILE HA 1 47 GLU HB2 4.480 . 5.150 3.974 3.365 4.412 . 0 0 "[ . 1 . 2]" 1
128 1 9 ILE HB 1 9 ILE MD 3.390 . 3.900 2.447 2.425 2.466 . 0 0 "[ . 1 . 2]" 1
129 1 9 ILE HB 1 14 PHE HE2 3.630 . 4.170 2.593 2.011 3.200 . 0 0 "[ . 1 . 2]" 1
130 1 9 ILE HB 1 44 PHE HA 5.170 . 5.950 5.104 4.629 5.504 . 0 0 "[ . 1 . 2]" 1
131 1 9 ILE HB 1 44 PHE QE 3.640 . 4.190 2.523 2.211 2.936 . 0 0 "[ . 1 . 2]" 1
132 1 9 ILE HB 1 44 PHE HZ 4.140 . 4.760 3.172 2.786 3.461 . 0 0 "[ . 1 . 2]" 1
133 1 9 ILE MD 1 9 ILE MG 3.190 . 3.670 1.941 1.922 1.964 . 0 0 "[ . 1 . 2]" 1
134 1 9 ILE MD 1 14 PHE HE2 3.510 . 4.040 3.081 2.279 3.987 . 0 0 "[ . 1 . 2]" 1
135 1 9 ILE MD 1 20 ALA MB 3.460 . 3.980 2.855 2.183 3.642 . 0 0 "[ . 1 . 2]" 1
136 1 9 ILE MD 1 24 MET ME 3.770 . 4.340 3.165 2.288 3.847 . 0 0 "[ . 1 . 2]" 1
137 1 9 ILE MD 1 44 PHE QE 4.370 . 5.030 3.244 2.810 3.530 . 0 0 "[ . 1 . 2]" 1
138 1 9 ILE MD 1 44 PHE HZ 3.780 . 4.350 2.761 2.454 3.111 . 0 0 "[ . 1 . 2]" 1
139 1 9 ILE MD 1 48 ALA H 4.730 . 5.440 4.000 3.671 4.465 . 0 0 "[ . 1 . 2]" 1
140 1 9 ILE MD 1 48 ALA HA 3.980 . 4.580 2.699 2.246 3.196 . 0 0 "[ . 1 . 2]" 1
141 1 9 ILE MD 1 48 ALA MB 3.600 . 4.140 2.299 2.008 3.080 . 0 0 "[ . 1 . 2]" 1
142 1 9 ILE MD 1 51 ARG QD 4.260 . 4.900 3.271 2.326 4.623 . 0 0 "[ . 1 . 2]" 1
143 1 9 ILE HG12 1 10 ALA H 4.750 . 5.460 4.595 4.455 4.697 . 0 0 "[ . 1 . 2]" 1
144 1 9 ILE HG12 1 14 PHE HE2 5.300 . 6.100 5.043 4.355 5.811 . 0 0 "[ . 1 . 2]" 1
145 1 9 ILE HG13 1 14 PHE HE2 4.150 . 4.770 3.739 3.128 4.437 . 0 0 "[ . 1 . 2]" 1
146 1 9 ILE MG 1 10 ALA H 4.160 . 4.780 2.997 2.779 3.129 . 0 0 "[ . 1 . 2]" 1
147 1 9 ILE MG 1 10 ALA HA 4.780 . 5.500 4.120 3.946 4.305 . 0 0 "[ . 1 . 2]" 1
148 1 9 ILE MG 1 10 ALA MB 3.390 . 3.900 2.518 2.385 2.695 . 0 0 "[ . 1 . 2]" 1
149 1 9 ILE MG 1 12 HIS H 4.890 . 5.620 4.559 4.449 4.860 . 0 0 "[ . 1 . 2]" 1
150 1 9 ILE MG 1 12 HIS HD2 4.370 . 5.030 4.287 3.842 4.792 . 0 0 "[ . 1 . 2]" 1
151 1 9 ILE MG 1 14 PHE HE2 4.560 . 5.240 4.016 3.485 4.578 . 0 0 "[ . 1 . 2]" 1
152 1 9 ILE MG 1 24 MET ME 4.480 . 5.150 4.504 3.363 5.173 0.023 15 0 "[ . 1 . 2]" 1
153 1 9 ILE MG 1 44 PHE H 5.110 . 5.880 5.221 4.820 5.572 . 0 0 "[ . 1 . 2]" 1
154 1 9 ILE MG 1 44 PHE HA 4.470 . 5.140 2.866 2.416 3.255 . 0 0 "[ . 1 . 2]" 1
155 1 9 ILE MG 1 44 PHE HB2 5.130 . 5.900 4.245 3.899 4.542 . 0 0 "[ . 1 . 2]" 1
156 1 9 ILE MG 1 44 PHE QD 3.260 . 3.750 2.998 2.823 3.181 . 0 0 "[ . 1 . 2]" 1
157 1 9 ILE MG 1 44 PHE QE 3.770 . 4.340 3.086 2.859 3.279 . 0 0 "[ . 1 . 2]" 1
158 1 9 ILE MG 1 44 PHE HZ 3.940 . 4.530 3.558 3.276 3.914 . 0 0 "[ . 1 . 2]" 1
159 1 9 ILE MG 1 47 GLU H 4.160 . 4.780 3.918 3.730 4.134 . 0 0 "[ . 1 . 2]" 1
160 1 9 ILE MG 1 47 GLU HA 4.690 . 5.390 4.209 3.930 4.434 . 0 0 "[ . 1 . 2]" 1
161 1 9 ILE MG 1 47 GLU HB2 3.470 . 3.990 2.176 1.945 2.532 . 0 0 "[ . 1 . 2]" 1
162 1 9 ILE MG 1 47 GLU HB3 4.120 . 4.740 2.588 2.258 3.144 . 0 0 "[ . 1 . 2]" 1
163 1 9 ILE MG 1 47 GLU HG2 4.760 . 5.470 4.125 3.846 4.591 . 0 0 "[ . 1 . 2]" 1
164 1 9 ILE MG 1 47 GLU HG3 4.760 . 5.470 3.660 3.144 4.193 . 0 0 "[ . 1 . 2]" 1
165 1 9 ILE MG 1 48 ALA H 3.670 . 4.220 2.636 2.281 3.010 . 0 0 "[ . 1 . 2]" 1
166 1 9 ILE MG 1 48 ALA HA 3.990 . 4.590 2.861 2.552 3.588 . 0 0 "[ . 1 . 2]" 1
167 1 9 ILE MG 1 48 ALA MB 3.260 . 3.750 2.210 1.881 2.806 . 0 0 "[ . 1 . 2]" 1
168 1 10 ALA H 1 11 GLY H 3.890 . 4.470 2.754 2.682 2.904 . 0 0 "[ . 1 . 2]" 1
169 1 10 ALA H 1 12 HIS H 4.730 . 5.440 4.156 3.997 4.339 . 0 0 "[ . 1 . 2]" 1
170 1 10 ALA H 1 47 GLU HB2 4.410 . 5.070 3.444 2.793 3.877 . 0 0 "[ . 1 . 2]" 1
171 1 10 ALA H 1 47 GLU QG 4.560 . 5.240 2.807 2.310 3.618 . 0 0 "[ . 1 . 2]" 1
172 1 10 ALA HA 1 11 GLY H 3.480 . 4.000 2.927 2.700 3.019 . 0 0 "[ . 1 . 2]" 1
173 1 10 ALA HA 1 11 GLY QA 4.750 . 5.460 4.073 3.997 4.111 . 0 0 "[ . 1 . 2]" 1
174 1 10 ALA HA 1 47 GLU HB2 5.380 . 6.190 4.104 3.663 4.777 . 0 0 "[ . 1 . 2]" 1
175 1 10 ALA HA 1 47 GLU HB3 5.070 . 5.830 4.183 3.508 4.930 . 0 0 "[ . 1 . 2]" 1
176 1 10 ALA HA 1 47 GLU QG 3.890 . 4.470 2.382 1.857 2.919 . 0 0 "[ . 1 . 2]" 1
177 1 10 ALA MB 1 11 GLY H 4.030 . 4.630 3.656 3.610 3.731 . 0 0 "[ . 1 . 2]" 1
178 1 10 ALA MB 1 12 HIS H 3.660 . 4.210 3.525 3.216 4.128 . 0 0 "[ . 1 . 2]" 1
179 1 10 ALA MB 1 12 HIS HD2 3.590 . 4.130 2.289 1.790 2.911 0.010 5 0 "[ . 1 . 2]" 1
180 1 10 ALA MB 1 44 PHE H 4.040 . 4.650 3.828 3.525 4.322 . 0 0 "[ . 1 . 2]" 1
181 1 10 ALA MB 1 44 PHE HA 3.310 . 3.810 2.071 1.912 2.368 . 0 0 "[ . 1 . 2]" 1
182 1 10 ALA MB 1 44 PHE HB2 4.320 . 4.970 3.197 2.872 3.633 . 0 0 "[ . 1 . 2]" 1
183 1 10 ALA MB 1 44 PHE HB3 4.770 . 5.490 4.295 4.063 4.643 . 0 0 "[ . 1 . 2]" 1
184 1 10 ALA MB 1 44 PHE QD 3.100 . 3.570 2.380 1.944 2.746 . 0 0 "[ . 1 . 2]" 1
185 1 10 ALA MB 1 46 VAL HB 5.500 . 6.330 5.136 4.822 5.429 . 0 0 "[ . 1 . 2]" 1
186 1 10 ALA MB 1 47 GLU H 4.280 . 4.920 3.857 3.541 4.105 . 0 0 "[ . 1 . 2]" 1
187 1 10 ALA MB 1 47 GLU HB2 3.270 . 3.760 2.598 2.200 3.102 . 0 0 "[ . 1 . 2]" 1
188 1 10 ALA MB 1 47 GLU HB3 4.090 . 4.700 3.591 3.214 4.088 . 0 0 "[ . 1 . 2]" 1
189 1 10 ALA MB 1 47 GLU HG2 4.000 . 4.600 2.905 2.617 3.219 . 0 0 "[ . 1 . 2]" 1
190 1 10 ALA MB 1 47 GLU QG 3.410 . 3.920 2.223 1.984 2.486 . 0 0 "[ . 1 . 2]" 1
191 1 10 ALA MB 1 47 GLU HG3 4.000 . 4.600 2.318 2.044 2.723 . 0 0 "[ . 1 . 2]" 1
192 1 11 GLY H 1 12 HIS H 3.400 . 3.910 2.553 2.208 2.865 . 0 0 "[ . 1 . 2]" 1
193 1 11 GLY H 1 47 GLU QG 5.310 . 6.110 4.802 4.190 5.355 . 0 0 "[ . 1 . 2]" 1
194 1 12 HIS H 1 12 HIS HB2 3.170 . 3.650 2.572 2.455 2.819 . 0 0 "[ . 1 . 2]" 1
195 1 12 HIS H 1 12 HIS HB3 3.830 . 4.400 3.701 3.614 3.886 . 0 0 "[ . 1 . 2]" 1
196 1 12 HIS H 1 12 HIS HD2 3.510 . 4.040 2.690 2.141 3.415 . 0 0 "[ . 1 . 2]" 1
197 1 12 HIS HA 1 12 HIS HD2 4.810 . 5.530 4.170 3.848 4.441 . 0 0 "[ . 1 . 2]" 1
198 1 12 HIS HA 1 13 GLU H 2.860 . 3.290 2.181 2.133 2.232 . 0 0 "[ . 1 . 2]" 1
199 1 12 HIS HA 1 14 PHE HE2 5.500 . 6.330 5.322 4.818 5.832 . 0 0 "[ . 1 . 2]" 1
200 1 12 HIS HB2 1 12 HIS HD2 3.690 . 4.240 2.875 2.763 3.038 . 0 0 "[ . 1 . 2]" 1
201 1 12 HIS HB2 1 13 GLU H 4.360 . 5.010 4.367 4.190 4.459 . 0 0 "[ . 1 . 2]" 1
202 1 12 HIS HB2 1 14 PHE HE2 3.470 . 3.990 2.814 2.402 3.318 . 0 0 "[ . 1 . 2]" 1
203 1 12 HIS HB2 1 14 PHE HZ 4.340 . 4.990 3.387 3.025 3.724 . 0 0 "[ . 1 . 2]" 1
204 1 12 HIS HB2 1 44 PHE QE 3.620 . 4.160 2.067 1.781 2.446 0.019 15 0 "[ . 1 . 2]" 1
205 1 12 HIS HB3 1 13 GLU H 3.900 . 4.490 3.680 3.213 3.927 . 0 0 "[ . 1 . 2]" 1
206 1 12 HIS HB3 1 14 PHE HE2 4.190 . 4.820 3.426 2.872 4.004 . 0 0 "[ . 1 . 2]" 1
207 1 12 HIS HB3 1 14 PHE HZ 4.640 . 5.340 2.975 2.579 3.423 . 0 0 "[ . 1 . 2]" 1
208 1 12 HIS HE1 1 23 PHE QE 5.500 . 6.330 4.286 2.998 5.123 . 0 0 "[ . 1 . 2]" 1
209 1 12 HIS HE1 1 23 PHE HZ 3.880 . 4.460 3.839 2.867 4.493 0.033 14 0 "[ . 1 . 2]" 1
210 1 13 GLU H 1 13 GLU QB 3.660 . 4.210 2.688 2.357 2.889 . 0 0 "[ . 1 . 2]" 1
211 1 13 GLU H 1 13 GLU HG2 4.220 . 4.850 2.727 1.889 3.782 . 0 0 "[ . 1 . 2]" 1
212 1 13 GLU H 1 13 GLU QG 3.460 . 3.980 2.375 1.870 3.121 . 0 0 "[ . 1 . 2]" 1
213 1 13 GLU H 1 13 GLU HG3 4.220 . 4.850 3.101 2.382 3.863 . 0 0 "[ . 1 . 2]" 1
214 1 13 GLU H 1 14 PHE H 4.760 . 5.470 4.409 4.195 4.578 . 0 0 "[ . 1 . 2]" 1
215 1 13 GLU H 1 14 PHE HD2 5.490 . 6.310 5.686 5.177 6.103 . 0 0 "[ . 1 . 2]" 1
216 1 13 GLU HA 1 13 GLU QG 3.720 . 4.280 3.173 2.428 3.535 . 0 0 "[ . 1 . 2]" 1
217 1 13 GLU HA 1 14 PHE H 3.180 . 3.660 2.165 2.134 2.208 . 0 0 "[ . 1 . 2]" 1
218 1 13 GLU QB 1 14 PHE H 4.200 . 4.830 3.316 2.909 3.659 . 0 0 "[ . 1 . 2]" 1
219 1 13 GLU HB2 1 14 PHE H 4.900 . 5.640 3.645 2.977 4.438 . 0 0 "[ . 1 . 2]" 1
220 1 13 GLU HB3 1 14 PHE H 4.900 . 5.640 4.092 3.344 4.413 . 0 0 "[ . 1 . 2]" 1
221 1 13 GLU QG 1 14 PHE H 4.220 . 4.850 4.245 3.897 4.472 . 0 0 "[ . 1 . 2]" 1
222 1 13 GLU HG2 1 14 PHE H 4.840 . 5.570 4.787 4.258 5.380 . 0 0 "[ . 1 . 2]" 1
223 1 13 GLU HG3 1 14 PHE H 4.840 . 5.570 4.923 4.066 5.479 . 0 0 "[ . 1 . 2]" 1
224 1 14 PHE H 1 14 PHE HB2 3.880 . 4.460 2.605 2.459 2.730 . 0 0 "[ . 1 . 2]" 1
225 1 14 PHE H 1 14 PHE HB3 4.090 . 4.700 3.731 3.645 3.818 . 0 0 "[ . 1 . 2]" 1
226 1 14 PHE H 1 14 PHE HD2 3.810 . 4.380 2.875 2.384 3.372 . 0 0 "[ . 1 . 2]" 1
227 1 14 PHE HA 1 14 PHE HD1 3.430 . 3.940 2.766 2.530 2.962 . 0 0 "[ . 1 . 2]" 1
228 1 14 PHE HA 1 15 ALA H 3.430 . 3.940 2.191 2.138 2.283 . 0 0 "[ . 1 . 2]" 1
229 1 14 PHE HA 1 15 ALA HA 4.590 . 5.280 4.382 4.306 4.504 . 0 0 "[ . 1 . 2]" 1
230 1 14 PHE HA 1 15 ALA MB 3.970 . 4.570 4.019 3.960 4.086 . 0 0 "[ . 1 . 2]" 1
231 1 14 PHE HA 1 16 ARG H 4.250 . 4.890 3.841 3.446 4.387 . 0 0 "[ . 1 . 2]" 1
232 1 14 PHE HB2 1 14 PHE HD2 3.380 . 3.890 2.358 2.310 2.409 . 0 0 "[ . 1 . 2]" 1
233 1 14 PHE HB2 1 14 PHE HE2 4.760 . 5.470 4.639 4.611 4.665 . 0 0 "[ . 1 . 2]" 1
234 1 14 PHE HB2 1 16 ARG H 4.320 . 4.970 3.847 3.394 4.460 . 0 0 "[ . 1 . 2]" 1
235 1 14 PHE HB2 1 20 ALA MB 3.970 . 4.570 2.815 2.498 3.486 . 0 0 "[ . 1 . 2]" 1
236 1 14 PHE HB3 1 14 PHE HD1 2.970 . 3.420 2.529 2.441 2.645 . 0 0 "[ . 1 . 2]" 1
237 1 14 PHE HB3 1 15 ALA H 4.320 . 4.970 3.326 2.750 3.842 . 0 0 "[ . 1 . 2]" 1
238 1 14 PHE HB3 1 15 ALA MB 4.800 . 5.520 4.770 4.387 5.253 . 0 0 "[ . 1 . 2]" 1
239 1 14 PHE HB3 1 16 ARG H 3.300 . 3.800 2.979 2.704 3.366 . 0 0 "[ . 1 . 2]" 1
240 1 14 PHE HB3 1 19 ASP HB2 3.550 . 4.080 3.470 1.777 4.101 0.023 10 0 "[ . 1 . 2]" 1
241 1 14 PHE HB3 1 20 ALA MB 3.960 . 4.550 3.211 2.738 3.820 . 0 0 "[ . 1 . 2]" 1
242 1 14 PHE HD1 1 15 ALA H 4.720 . 5.430 4.256 3.834 4.785 . 0 0 "[ . 1 . 2]" 1
243 1 14 PHE HD1 1 16 ARG H 5.320 . 6.120 4.957 4.761 5.335 . 0 0 "[ . 1 . 2]" 1
244 1 14 PHE HD1 1 19 ASP HB2 3.990 . 4.590 4.237 3.140 4.650 0.060 19 0 "[ . 1 . 2]" 1
245 1 14 PHE HD2 1 20 ALA MB 3.950 . 4.540 2.921 2.670 3.337 . 0 0 "[ . 1 . 2]" 1
246 1 14 PHE HE1 1 20 ALA HA 4.640 . 5.340 3.711 3.360 4.495 . 0 0 "[ . 1 . 2]" 1
247 1 14 PHE HE1 1 23 PHE H 4.710 . 5.420 4.473 4.026 5.079 . 0 0 "[ . 1 . 2]" 1
248 1 14 PHE HE1 1 23 PHE HA 5.230 . 6.010 4.765 4.371 5.359 . 0 0 "[ . 1 . 2]" 1
249 1 14 PHE HE1 1 23 PHE HB2 4.250 . 4.890 2.456 2.046 3.162 . 0 0 "[ . 1 . 2]" 1
250 1 14 PHE HE1 1 23 PHE QB 3.680 . 4.230 2.395 2.021 3.097 . 0 0 "[ . 1 . 2]" 1
251 1 14 PHE HE1 1 23 PHE HB3 4.250 . 4.890 3.384 2.910 4.427 . 0 0 "[ . 1 . 2]" 1
252 1 14 PHE HE1 1 23 PHE QD 5.330 . 6.130 3.346 2.981 3.869 . 0 0 "[ . 1 . 2]" 1
253 1 14 PHE HE2 1 20 ALA MB 3.880 . 4.460 3.744 3.469 4.164 . 0 0 "[ . 1 . 2]" 1
254 1 14 PHE HE2 1 24 MET ME 5.500 . 6.330 5.136 4.095 5.988 . 0 0 "[ . 1 . 2]" 1
255 1 14 PHE HZ 1 23 PHE QD 4.270 . 4.910 3.077 2.666 3.531 . 0 0 "[ . 1 . 2]" 1
256 1 14 PHE HZ 1 44 PHE QE 4.230 . 4.860 2.747 2.201 3.283 . 0 0 "[ . 1 . 2]" 1
257 1 14 PHE HZ 1 44 PHE HZ 4.110 . 4.730 2.906 2.142 3.737 . 0 0 "[ . 1 . 2]" 1
258 1 15 ALA H 1 15 ALA MB 3.230 . 3.710 2.250 2.230 2.296 . 0 0 "[ . 1 . 2]" 1
259 1 15 ALA H 1 16 ARG H 3.660 . 4.210 2.692 2.438 2.840 . 0 0 "[ . 1 . 2]" 1
260 1 15 ALA H 1 19 ASP HB2 5.000 . 5.750 4.277 3.576 5.248 . 0 0 "[ . 1 . 2]" 1
261 1 15 ALA H 1 19 ASP HB3 4.690 . 5.390 3.857 2.967 4.553 . 0 0 "[ . 1 . 2]" 1
262 1 15 ALA MB 1 16 ARG H 3.040 . 3.500 2.979 2.415 3.415 . 0 0 "[ . 1 . 2]" 1
263 1 15 ALA MB 1 19 ASP HB2 5.260 . 6.050 4.376 2.847 5.219 . 0 0 "[ . 1 . 2]" 1
264 1 16 ARG H 1 16 ARG HB2 4.000 . 4.600 3.587 2.841 4.014 . 0 0 "[ . 1 . 2]" 1
265 1 16 ARG H 1 16 ARG QB 3.280 . 3.770 2.955 2.420 3.389 . 0 0 "[ . 1 . 2]" 1
266 1 16 ARG H 1 16 ARG HB3 4.000 . 4.600 3.151 2.622 3.690 . 0 0 "[ . 1 . 2]" 1
267 1 16 ARG H 1 16 ARG HG2 5.070 . 5.830 3.662 2.133 5.177 . 0 0 "[ . 1 . 2]" 1
268 1 16 ARG H 1 16 ARG QG 4.410 . 5.070 3.361 2.096 4.333 . 0 0 "[ . 1 . 2]" 1
269 1 16 ARG H 1 16 ARG HG3 5.070 . 5.830 4.108 2.818 4.856 . 0 0 "[ . 1 . 2]" 1
270 1 16 ARG H 1 19 ASP H 4.020 . 4.620 3.900 3.307 4.312 . 0 0 "[ . 1 . 2]" 1
271 1 16 ARG H 1 19 ASP HB2 4.280 . 4.920 3.168 2.296 3.910 . 0 0 "[ . 1 . 2]" 1
272 1 16 ARG H 1 19 ASP HB3 4.290 . 4.930 2.944 1.926 4.256 . 0 0 "[ . 1 . 2]" 1
273 1 16 ARG H 1 20 ALA H 5.500 . 6.330 4.449 3.836 4.990 . 0 0 "[ . 1 . 2]" 1
274 1 16 ARG HA 1 16 ARG HD2 4.920 . 5.660 4.538 3.723 5.553 . 0 0 "[ . 1 . 2]" 1
275 1 16 ARG HA 1 16 ARG QD 4.250 . 4.890 3.854 2.130 4.525 . 0 0 "[ . 1 . 2]" 1
276 1 16 ARG HA 1 16 ARG HD3 4.920 . 5.660 4.360 2.142 5.192 . 0 0 "[ . 1 . 2]" 1
277 1 16 ARG HA 1 18 ALA H 4.340 . 4.990 4.403 4.007 4.704 . 0 0 "[ . 1 . 2]" 1
278 1 16 ARG QB 1 18 ALA H 3.980 . 4.580 3.353 2.837 3.997 . 0 0 "[ . 1 . 2]" 1
279 1 16 ARG QB 1 19 ASP H 4.150 . 4.770 3.173 2.249 4.211 . 0 0 "[ . 1 . 2]" 1
280 1 16 ARG QB 1 19 ASP HB2 5.030 . 5.780 3.378 1.874 5.105 . 0 0 "[ . 1 . 2]" 1
281 1 16 ARG QD 1 19 ASP H 4.130 . 4.750 3.901 3.317 4.630 . 0 0 "[ . 1 . 2]" 1
282 1 16 ARG HD2 1 18 ALA H 5.500 . 6.330 4.286 3.487 5.922 . 0 0 "[ . 1 . 2]" 1
283 1 16 ARG HD3 1 18 ALA H 5.500 . 6.330 4.580 3.629 5.527 . 0 0 "[ . 1 . 2]" 1
284 1 16 ARG QG 1 19 ASP H 3.520 . 4.050 2.489 1.782 3.254 0.018 14 0 "[ . 1 . 2]" 1
285 1 16 ARG QG 1 19 ASP HB2 5.340 . 6.140 3.248 1.846 4.623 . 0 0 "[ . 1 . 2]" 1
286 1 17 LYS H 1 18 ALA MB 5.140 . 5.910 4.436 4.219 4.576 . 0 0 "[ . 1 . 2]" 1
287 1 17 LYS HA 1 19 ASP H 4.560 . 5.240 4.110 3.849 4.416 . 0 0 "[ . 1 . 2]" 1
288 1 17 LYS HA 1 19 ASP HB3 5.200 . 5.980 5.205 4.769 6.147 0.167 3 0 "[ . 1 . 2]" 1
289 1 17 LYS HA 1 20 ALA H 4.610 . 5.300 3.489 3.202 4.072 . 0 0 "[ . 1 . 2]" 1
290 1 17 LYS HA 1 20 ALA MB 3.400 . 3.910 3.034 2.455 3.807 . 0 0 "[ . 1 . 2]" 1
291 1 17 LYS HA 1 21 LEU H 4.830 . 5.550 4.457 4.116 5.287 . 0 0 "[ . 1 . 2]" 1
292 1 17 LYS HA 1 96 VAL MG1 5.200 . 5.980 4.775 2.712 5.862 . 0 0 "[ . 1 . 2]" 1
293 1 17 LYS HB2 1 18 ALA H 4.040 . 4.650 3.770 2.641 4.108 . 0 0 "[ . 1 . 2]" 1
294 1 17 LYS HB2 1 96 VAL HA 4.970 . 5.720 5.017 3.846 5.777 0.057 1 0 "[ . 1 . 2]" 1
295 1 17 LYS HB2 1 96 VAL MG2 4.330 . 4.980 4.217 2.858 5.048 0.068 20 0 "[ . 1 . 2]" 1
296 1 17 LYS HB3 1 18 ALA H 4.540 . 5.220 2.661 2.405 3.191 . 0 0 "[ . 1 . 2]" 1
297 1 17 LYS HB3 1 18 ALA MB 4.230 . 4.860 4.062 3.689 4.497 . 0 0 "[ . 1 . 2]" 1
298 1 17 LYS HB3 1 96 VAL MG1 3.630 . 4.170 3.295 2.338 4.181 0.011 1 0 "[ . 1 . 2]" 1
299 1 17 LYS HB3 1 96 VAL MG2 3.860 . 4.440 3.979 3.087 4.537 0.097 8 0 "[ . 1 . 2]" 1
300 1 17 LYS QD 1 20 ALA H 5.190 . 5.970 4.721 3.953 5.575 . 0 0 "[ . 1 . 2]" 1
301 1 17 LYS QD 1 20 ALA MB 4.440 . 5.110 3.359 2.033 4.999 . 0 0 "[ . 1 . 2]" 1
302 1 17 LYS QD 1 96 VAL MG1 4.050 . 4.660 3.631 2.840 4.700 0.040 1 0 "[ . 1 . 2]" 1
303 1 17 LYS QD 1 96 VAL MG2 4.560 . 5.240 3.357 1.806 4.649 . 0 0 "[ . 1 . 2]" 1
304 1 17 LYS QE 1 21 LEU QD 3.630 . 4.170 2.566 1.683 3.710 0.117 19 0 "[ . 1 . 2]" 1
305 1 17 LYS HE2 1 21 LEU QD 4.230 . 4.860 3.151 1.741 4.556 0.059 8 0 "[ . 1 . 2]" 1
306 1 17 LYS HE3 1 21 LEU QD 4.230 . 4.860 2.936 1.697 4.274 0.103 19 0 "[ . 1 . 2]" 1
307 1 17 LYS QG 1 21 LEU QD 3.960 . 4.550 3.071 2.341 4.223 . 0 0 "[ . 1 . 2]" 1
308 1 17 LYS QG 1 96 VAL HA 4.540 . 5.220 3.225 2.202 4.926 . 0 0 "[ . 1 . 2]" 1
309 1 17 LYS QG 1 96 VAL MG1 3.710 . 4.270 2.194 1.780 3.105 0.020 17 0 "[ . 1 . 2]" 1
310 1 17 LYS QG 1 96 VAL MG2 4.560 . 5.240 2.439 1.800 3.577 0.000 12 0 "[ . 1 . 2]" 1
311 1 17 LYS HG2 1 96 VAL MG1 4.350 . 5.000 2.766 1.788 3.693 0.012 7 0 "[ . 1 . 2]" 1
312 1 17 LYS HG3 1 96 VAL MG1 4.350 . 5.000 2.957 1.789 4.439 0.011 6 0 "[ . 1 . 2]" 1
313 1 18 ALA H 1 18 ALA MB 2.930 . 3.370 2.236 2.223 2.253 . 0 0 "[ . 1 . 2]" 1
314 1 18 ALA H 1 19 ASP H 3.950 . 4.540 2.739 2.598 2.882 . 0 0 "[ . 1 . 2]" 1
315 1 18 ALA H 1 20 ALA H 5.140 . 5.910 4.427 4.134 4.834 . 0 0 "[ . 1 . 2]" 1
316 1 18 ALA H 1 20 ALA MB 5.500 . 6.330 5.075 4.685 5.471 . 0 0 "[ . 1 . 2]" 1
317 1 18 ALA H 1 21 LEU QD 5.500 . 6.330 4.329 3.916 4.990 . 0 0 "[ . 1 . 2]" 1
318 1 18 ALA HA 1 20 ALA H 4.830 . 5.550 4.463 4.223 4.805 . 0 0 "[ . 1 . 2]" 1
319 1 18 ALA HA 1 20 ALA MB 5.190 . 5.970 4.858 4.636 5.177 . 0 0 "[ . 1 . 2]" 1
320 1 18 ALA HA 1 21 LEU HB2 3.480 . 4.000 2.685 2.352 3.218 . 0 0 "[ . 1 . 2]" 1
321 1 18 ALA HA 1 21 LEU QD 3.170 . 3.650 2.509 1.963 3.254 . 0 0 "[ . 1 . 2]" 1
322 1 18 ALA HA 1 21 LEU HG 3.540 . 4.070 3.136 2.747 3.654 . 0 0 "[ . 1 . 2]" 1
323 1 18 ALA MB 1 19 ASP H 3.340 . 3.840 2.763 2.392 2.989 . 0 0 "[ . 1 . 2]" 1
324 1 18 ALA MB 1 20 ALA H 4.800 . 5.520 4.723 4.419 5.006 . 0 0 "[ . 1 . 2]" 1
325 1 18 ALA MB 1 21 LEU H 4.860 . 5.590 4.626 4.413 4.841 . 0 0 "[ . 1 . 2]" 1
326 1 19 ASP H 1 19 ASP HB2 3.290 . 3.780 2.417 2.290 2.520 . 0 0 "[ . 1 . 2]" 1
327 1 19 ASP H 1 19 ASP HB3 3.390 . 3.900 2.786 2.494 3.567 . 0 0 "[ . 1 . 2]" 1
328 1 19 ASP H 1 20 ALA H 3.190 . 3.670 2.670 2.455 2.891 . 0 0 "[ . 1 . 2]" 1
329 1 19 ASP H 1 20 ALA MB 4.410 . 5.070 4.320 4.140 4.488 . 0 0 "[ . 1 . 2]" 1
330 1 19 ASP H 1 21 LEU H 4.530 . 5.210 4.118 3.875 4.340 . 0 0 "[ . 1 . 2]" 1
331 1 19 ASP HA 1 21 LEU H 4.770 . 5.490 4.527 4.309 4.787 . 0 0 "[ . 1 . 2]" 1
332 1 19 ASP HA 1 22 ALA H 3.840 . 4.420 3.495 3.159 3.881 . 0 0 "[ . 1 . 2]" 1
333 1 19 ASP HA 1 22 ALA MB 3.130 . 3.600 2.654 2.409 3.001 . 0 0 "[ . 1 . 2]" 1
334 1 19 ASP HA 1 23 PHE H 4.550 . 5.230 4.202 3.746 5.041 . 0 0 "[ . 1 . 2]" 1
335 1 19 ASP HB2 1 20 ALA H 4.280 . 4.920 3.538 2.327 3.881 . 0 0 "[ . 1 . 2]" 1
336 1 19 ASP HB2 1 20 ALA MB 5.200 . 5.980 5.039 3.918 5.363 . 0 0 "[ . 1 . 2]" 1
337 1 19 ASP HB3 1 20 ALA H 3.960 . 4.550 2.714 2.498 3.337 . 0 0 "[ . 1 . 2]" 1
338 1 19 ASP HB3 1 20 ALA MB 4.470 . 5.140 4.087 3.841 4.667 . 0 0 "[ . 1 . 2]" 1
339 1 19 ASP HB3 1 21 LEU H 5.220 . 6.000 5.167 4.955 5.596 . 0 0 "[ . 1 . 2]" 1
340 1 20 ALA H 1 20 ALA MB 3.140 . 3.610 2.242 2.235 2.253 . 0 0 "[ . 1 . 2]" 1
341 1 20 ALA H 1 21 LEU H 3.310 . 3.810 2.736 2.621 2.845 . 0 0 "[ . 1 . 2]" 1
342 1 20 ALA H 1 21 LEU HB2 4.950 . 5.690 4.919 4.781 5.113 . 0 0 "[ . 1 . 2]" 1
343 1 20 ALA H 1 21 LEU HG 4.870 . 5.600 4.463 4.261 4.881 . 0 0 "[ . 1 . 2]" 1
344 1 20 ALA H 1 22 ALA H 4.630 . 5.320 4.165 4.008 4.338 . 0 0 "[ . 1 . 2]" 1
345 1 20 ALA HA 1 23 PHE H 4.160 . 4.780 3.610 3.435 3.926 . 0 0 "[ . 1 . 2]" 1
346 1 20 ALA HA 1 23 PHE QB 4.510 . 5.190 2.879 2.617 3.273 . 0 0 "[ . 1 . 2]" 1
347 1 20 ALA MB 1 21 LEU H 3.020 . 3.470 2.480 2.372 2.610 . 0 0 "[ . 1 . 2]" 1
348 1 20 ALA MB 1 23 PHE QB 4.990 . 5.740 4.060 3.872 4.407 . 0 0 "[ . 1 . 2]" 1
349 1 20 ALA MB 1 24 MET QG 4.730 . 5.440 3.908 3.488 4.413 . 0 0 "[ . 1 . 2]" 1
350 1 21 LEU H 1 21 LEU HB2 3.350 . 3.850 2.532 2.432 2.596 . 0 0 "[ . 1 . 2]" 1
351 1 21 LEU H 1 21 LEU HB3 3.940 . 4.530 3.605 3.590 3.621 . 0 0 "[ . 1 . 2]" 1
352 1 21 LEU H 1 21 LEU QD . . 3.770 2.972 2.848 3.151 . 0 0 "[ . 1 . 2]" 1
353 1 21 LEU H 1 21 LEU HG 2.940 . 3.380 2.252 2.138 2.581 . 0 0 "[ . 1 . 2]" 1
354 1 21 LEU H 1 22 ALA H 3.000 . 3.450 2.710 2.592 2.799 . 0 0 "[ . 1 . 2]" 1
355 1 21 LEU H 1 22 ALA MB 4.570 . 5.260 4.360 4.248 4.421 . 0 0 "[ . 1 . 2]" 1
356 1 21 LEU HA 1 21 LEU QD 3.060 . 3.520 2.015 1.902 2.111 . 0 0 "[ . 1 . 2]" 1
357 1 21 LEU HA 1 24 MET HB2 4.120 . 4.740 2.849 2.481 3.368 . 0 0 "[ . 1 . 2]" 1
358 1 21 LEU HA 1 24 MET ME 3.770 . 4.340 2.867 1.919 4.168 . 0 0 "[ . 1 . 2]" 1
359 1 21 LEU HA 1 24 MET QG 4.890 . 5.620 3.816 2.770 4.741 . 0 0 "[ . 1 . 2]" 1
360 1 21 LEU HA 1 25 LYS H 4.560 . 5.240 4.035 3.024 4.406 . 0 0 "[ . 1 . 2]" 1
361 1 21 LEU HA 1 92 TYR QD 4.410 . 5.070 3.094 2.372 4.033 . 0 0 "[ . 1 . 2]" 1
362 1 21 LEU HA 1 92 TYR QE 3.680 . 4.230 3.408 2.718 4.197 . 0 0 "[ . 1 . 2]" 1
363 1 21 LEU HA 1 93 LYS HA 4.920 . 5.660 4.965 4.177 5.557 . 0 0 "[ . 1 . 2]" 1
364 1 21 LEU HB2 1 21 LEU QD 3.110 . 3.580 2.319 2.267 2.373 . 0 0 "[ . 1 . 2]" 1
365 1 21 LEU HB2 1 22 ALA H 3.290 . 3.780 2.606 2.451 2.813 . 0 0 "[ . 1 . 2]" 1
366 1 21 LEU HB3 1 22 ALA H 3.700 . 4.260 3.655 3.471 3.842 . 0 0 "[ . 1 . 2]" 1
367 1 21 LEU HB3 1 92 TYR QE 3.680 . 4.230 3.377 2.752 3.988 . 0 0 "[ . 1 . 2]" 1
368 1 21 LEU QD 1 22 ALA H 4.810 . 5.530 4.085 4.015 4.181 . 0 0 "[ . 1 . 2]" 1
369 1 21 LEU QD 1 24 MET H 5.460 . 6.280 4.876 4.424 5.205 . 0 0 "[ . 1 . 2]" 1
370 1 21 LEU QD 1 24 MET ME 3.310 . 3.810 2.590 1.820 3.568 . 0 0 "[ . 1 . 2]" 1
371 1 21 LEU QD 1 92 TYR QD 3.270 . 3.760 2.257 1.797 3.389 0.003 14 0 "[ . 1 . 2]" 1
372 1 21 LEU QD 1 92 TYR QE . . 3.690 3.145 2.425 3.570 . 0 0 "[ . 1 . 2]" 1
373 1 21 LEU QD 1 93 LYS HA 3.080 . 3.540 2.001 1.740 2.384 0.060 8 0 "[ . 1 . 2]" 1
374 1 21 LEU QD 1 93 LYS QB 3.200 . 3.680 2.837 2.144 3.487 . 0 0 "[ . 1 . 2]" 1
375 1 21 LEU QD 1 95 CYS H 4.300 . 4.950 3.758 2.636 4.567 . 0 0 "[ . 1 . 2]" 1
376 1 22 ALA H 1 22 ALA MB 2.680 . 3.080 2.239 2.232 2.255 . 0 0 "[ . 1 . 2]" 1
377 1 22 ALA H 1 23 PHE H 3.310 . 3.810 2.807 2.681 2.963 . 0 0 "[ . 1 . 2]" 1
378 1 22 ALA H 1 23 PHE HB2 5.460 . 6.280 5.195 5.032 5.395 . 0 0 "[ . 1 . 2]" 1
379 1 22 ALA H 1 23 PHE QB 4.770 . 5.490 4.499 4.299 4.606 . 0 0 "[ . 1 . 2]" 1
380 1 22 ALA H 1 23 PHE HB3 5.460 . 6.280 4.934 4.666 5.084 . 0 0 "[ . 1 . 2]" 1
381 1 22 ALA HA 1 25 LYS H 3.720 . 4.280 3.545 3.265 4.306 0.026 8 0 "[ . 1 . 2]" 1
382 1 22 ALA HA 1 25 LYS HA 5.500 . 6.330 5.403 4.998 6.367 0.037 8 0 "[ . 1 . 2]" 1
383 1 22 ALA HA 1 25 LYS HB3 3.260 . 3.750 2.736 2.297 3.661 . 0 0 "[ . 1 . 2]" 1
384 1 22 ALA HA 1 26 VAL MG2 4.510 . 5.190 3.763 3.166 4.293 . 0 0 "[ . 1 . 2]" 1
385 1 22 ALA MB 1 23 PHE H 3.250 . 3.740 2.425 2.160 2.884 . 0 0 "[ . 1 . 2]" 1
386 1 22 ALA MB 1 23 PHE HA 4.380 . 5.040 3.857 3.779 4.070 . 0 0 "[ . 1 . 2]" 1
387 1 22 ALA MB 1 23 PHE QB 4.320 . 4.970 3.821 3.684 3.989 . 0 0 "[ . 1 . 2]" 1
388 1 22 ALA MB 1 26 VAL H 4.740 . 5.450 4.588 4.345 5.175 . 0 0 "[ . 1 . 2]" 1
389 1 22 ALA MB 1 26 VAL MG2 3.780 . 4.350 3.359 3.071 3.703 . 0 0 "[ . 1 . 2]" 1
390 1 23 PHE H 1 23 PHE HB2 3.290 . 3.780 2.523 2.445 2.696 . 0 0 "[ . 1 . 2]" 1
391 1 23 PHE H 1 23 PHE HB3 3.290 . 3.780 2.546 2.470 2.640 . 0 0 "[ . 1 . 2]" 1
392 1 23 PHE H 1 23 PHE QD 4.690 . 5.390 4.203 4.185 4.247 . 0 0 "[ . 1 . 2]" 1
393 1 23 PHE H 1 25 LYS H 4.690 . 5.390 4.126 3.849 4.430 . 0 0 "[ . 1 . 2]" 1
394 1 23 PHE HA 1 23 PHE QD 3.860 . 4.440 2.800 2.691 2.971 . 0 0 "[ . 1 . 2]" 1
395 1 23 PHE HA 1 26 VAL H 4.050 . 4.660 3.637 3.288 4.041 . 0 0 "[ . 1 . 2]" 1
396 1 23 PHE HA 1 26 VAL HB 3.730 . 4.290 3.122 2.767 3.704 . 0 0 "[ . 1 . 2]" 1
397 1 23 PHE HA 1 26 VAL MG1 4.580 . 5.270 4.390 4.042 4.993 . 0 0 "[ . 1 . 2]" 1
398 1 23 PHE HA 1 26 VAL MG2 3.710 . 4.270 3.077 2.575 3.663 . 0 0 "[ . 1 . 2]" 1
399 1 23 PHE HA 1 27 MET H 4.660 . 5.360 4.307 3.957 4.872 . 0 0 "[ . 1 . 2]" 1
400 1 23 PHE QB 1 24 MET H 3.560 . 4.090 2.345 2.152 2.475 . 0 0 "[ . 1 . 2]" 1
401 1 23 PHE QB 1 25 LYS H 5.340 . 6.140 4.633 4.345 4.855 . 0 0 "[ . 1 . 2]" 1
402 1 23 PHE HB2 1 24 MET H 4.170 . 4.800 3.771 3.644 3.876 . 0 0 "[ . 1 . 2]" 1
403 1 23 PHE HB3 1 24 MET H 4.170 . 4.800 2.368 2.167 2.505 . 0 0 "[ . 1 . 2]" 1
404 1 23 PHE QD 1 24 MET H 4.090 . 4.700 3.172 2.912 3.353 . 0 0 "[ . 1 . 2]" 1
405 1 23 PHE QD 1 24 MET QG 4.490 . 5.160 2.810 2.419 3.158 . 0 0 "[ . 1 . 2]" 1
406 1 23 PHE QD 1 27 MET ME 4.320 . 4.970 3.444 2.652 4.471 . 0 0 "[ . 1 . 2]" 1
407 1 23 PHE QD 1 44 PHE QE 3.770 . 4.340 3.135 2.792 3.499 . 0 0 "[ . 1 . 2]" 1
408 1 23 PHE QE 1 27 MET ME 3.580 . 4.120 3.203 2.573 3.833 . 0 0 "[ . 1 . 2]" 1
409 1 23 PHE QE 1 44 PHE QD 4.950 . 5.200 3.432 3.141 3.841 . 0 0 "[ . 1 . 2]" 1
410 1 23 PHE QE 1 44 PHE QE 5.060 . 5.820 3.641 3.390 4.126 . 0 0 "[ . 1 . 2]" 1
411 1 23 PHE HZ 1 27 MET ME 5.080 . 5.840 4.825 3.995 5.419 . 0 0 "[ . 1 . 2]" 1
412 1 24 MET H 1 24 MET HB2 3.870 . 4.450 2.448 2.341 2.579 . 0 0 "[ . 1 . 2]" 1
413 1 24 MET H 1 24 MET HB3 3.690 . 4.240 3.597 3.571 3.606 . 0 0 "[ . 1 . 2]" 1
414 1 24 MET H 1 24 MET HG2 4.080 . 4.690 3.507 3.263 3.715 . 0 0 "[ . 1 . 2]" 1
415 1 24 MET H 1 24 MET QG 3.440 . 3.960 2.299 2.074 2.463 . 0 0 "[ . 1 . 2]" 1
416 1 24 MET H 1 24 MET HG3 4.080 . 4.690 2.331 2.097 2.500 . 0 0 "[ . 1 . 2]" 1
417 1 24 MET H 1 25 LYS H 3.430 . 3.940 2.771 2.605 2.922 . 0 0 "[ . 1 . 2]" 1
418 1 24 MET H 1 26 VAL H 4.330 . 4.980 4.368 4.127 4.666 . 0 0 "[ . 1 . 2]" 1
419 1 24 MET H 1 26 VAL MG2 5.500 . 6.330 5.111 4.713 5.510 . 0 0 "[ . 1 . 2]" 1
420 1 24 MET H 1 27 MET ME 4.610 . 5.300 4.427 3.946 5.474 0.174 2 0 "[ . 1 . 2]" 1
421 1 24 MET H 1 27 MET HG2 5.500 . 6.330 4.662 4.117 6.326 . 0 0 "[ . 1 . 2]" 1
422 1 24 MET H 1 27 MET HG3 5.500 . 6.330 5.855 4.600 6.320 . 0 0 "[ . 1 . 2]" 1
423 1 24 MET H 1 44 PHE QE 5.040 . 5.800 4.497 3.929 5.128 . 0 0 "[ . 1 . 2]" 1
424 1 24 MET HA 1 24 MET ME 5.230 . 6.010 4.526 4.418 4.691 . 0 0 "[ . 1 . 2]" 1
425 1 24 MET HA 1 24 MET HG2 3.930 . 4.520 2.489 2.397 2.600 . 0 0 "[ . 1 . 2]" 1
426 1 24 MET HA 1 24 MET QG 3.380 . 3.890 2.375 2.293 2.478 . 0 0 "[ . 1 . 2]" 1
427 1 24 MET HA 1 24 MET HG3 3.930 . 4.520 3.006 2.822 3.124 . 0 0 "[ . 1 . 2]" 1
428 1 24 MET HA 1 27 MET H 4.020 . 4.620 3.840 3.630 4.184 . 0 0 "[ . 1 . 2]" 1
429 1 24 MET HA 1 27 MET HB2 5.000 . 5.750 4.986 3.021 5.772 0.022 11 0 "[ . 1 . 2]" 1
430 1 24 MET HA 1 27 MET QB 4.360 . 5.010 4.170 2.980 4.839 . 0 0 "[ . 1 . 2]" 1
431 1 24 MET HA 1 27 MET HB3 5.000 . 5.750 4.533 4.003 5.195 . 0 0 "[ . 1 . 2]" 1
432 1 24 MET HA 1 27 MET ME 3.630 . 4.170 2.240 1.780 3.674 0.020 1 0 "[ . 1 . 2]" 1
433 1 24 MET HA 1 78 PHE HE2 4.120 . 4.740 3.943 3.574 4.229 . 0 0 "[ . 1 . 2]" 1
434 1 24 MET HB2 1 92 TYR QD 5.280 . 6.070 3.259 2.699 4.293 . 0 0 "[ . 1 . 2]" 1
435 1 24 MET HB3 1 25 LYS H 4.690 . 5.390 3.656 3.456 3.905 . 0 0 "[ . 1 . 2]" 1
436 1 24 MET HB3 1 78 PHE HD2 4.570 . 5.260 4.276 3.760 4.837 . 0 0 "[ . 1 . 2]" 1
437 1 24 MET HB3 1 92 TYR QD 5.200 . 5.980 3.678 2.722 4.884 . 0 0 "[ . 1 . 2]" 1
438 1 24 MET HB3 1 92 TYR QE 4.710 . 5.420 3.863 2.874 4.598 . 0 0 "[ . 1 . 2]" 1
439 1 24 MET ME 1 44 PHE QD 4.560 . 5.240 4.628 3.559 5.179 . 0 0 "[ . 1 . 2]" 1
440 1 24 MET ME 1 44 PHE QE 3.180 . 3.660 2.913 2.031 3.527 . 0 0 "[ . 1 . 2]" 1
441 1 24 MET ME 1 45 LEU HA 5.500 . 6.330 5.314 3.984 6.032 . 0 0 "[ . 1 . 2]" 1
442 1 24 MET ME 1 45 LEU QD 4.090 . 4.700 4.058 3.353 4.537 . 0 0 "[ . 1 . 2]" 1
443 1 24 MET ME 1 48 ALA MB 3.150 . 3.620 3.206 2.157 3.705 0.085 3 0 "[ . 1 . 2]" 1
444 1 24 MET ME 1 92 TYR QD 3.530 . 4.060 2.821 1.787 4.048 0.013 4 0 "[ . 1 . 2]" 1
445 1 24 MET ME 1 95 CYS QB 5.340 . 6.140 4.532 2.150 6.122 . 0 0 "[ . 1 . 2]" 1
446 1 24 MET QG 1 25 LYS H 4.960 . 5.700 4.205 3.945 4.413 . 0 0 "[ . 1 . 2]" 1
447 1 24 MET QG 1 27 MET ME 3.560 . 4.090 2.525 1.794 3.832 0.006 3 0 "[ . 1 . 2]" 1
448 1 24 MET QG 1 44 PHE QE 3.430 . 3.940 2.089 1.867 2.400 . 0 0 "[ . 1 . 2]" 1
449 1 24 MET QG 1 45 LEU QD 4.200 . 4.830 3.141 2.545 3.905 . 0 0 "[ . 1 . 2]" 1
450 1 24 MET HG2 1 44 PHE QE 3.980 . 4.580 2.365 1.895 2.968 . 0 0 "[ . 1 . 2]" 1
451 1 24 MET HG2 1 45 LEU QD 4.980 . 5.730 3.205 2.583 4.007 . 0 0 "[ . 1 . 2]" 1
452 1 24 MET HG3 1 44 PHE QE 3.980 . 4.580 2.547 2.034 3.435 . 0 0 "[ . 1 . 2]" 1
453 1 24 MET HG3 1 45 LEU QD 4.980 . 5.730 4.524 3.835 5.397 . 0 0 "[ . 1 . 2]" 1
454 1 25 LYS H 1 25 LYS HB2 3.140 . 3.610 2.529 2.329 2.838 . 0 0 "[ . 1 . 2]" 1
455 1 25 LYS H 1 25 LYS HB3 3.320 . 3.820 2.563 2.390 2.704 . 0 0 "[ . 1 . 2]" 1
456 1 25 LYS H 1 25 LYS HD2 5.500 . 6.330 4.874 4.476 5.291 . 0 0 "[ . 1 . 2]" 1
457 1 25 LYS H 1 25 LYS HD3 5.500 . 6.330 5.076 4.553 5.951 . 0 0 "[ . 1 . 2]" 1
458 1 25 LYS H 1 25 LYS QG 4.360 . 5.010 4.011 3.943 4.101 . 0 0 "[ . 1 . 2]" 1
459 1 25 LYS H 1 26 VAL H 3.610 . 4.150 2.729 2.501 2.864 . 0 0 "[ . 1 . 2]" 1
460 1 25 LYS H 1 26 VAL MG2 4.490 . 5.160 4.157 3.915 4.323 . 0 0 "[ . 1 . 2]" 1
461 1 25 LYS H 1 27 MET H 4.770 . 5.490 4.556 4.258 4.772 . 0 0 "[ . 1 . 2]" 1
462 1 25 LYS H 1 92 TYR QE 4.460 . 5.130 3.822 3.185 4.671 . 0 0 "[ . 1 . 2]" 1
463 1 25 LYS HA 1 25 LYS QG 3.380 . 3.890 2.563 2.330 3.002 . 0 0 "[ . 1 . 2]" 1
464 1 25 LYS HA 1 28 LEU HB3 3.780 . 4.350 2.450 1.808 3.115 . 0 0 "[ . 1 . 2]" 1
465 1 25 LYS HA 1 28 LEU MD2 3.990 . 4.590 2.914 2.669 3.453 . 0 0 "[ . 1 . 2]" 1
466 1 25 LYS HA 1 92 TYR QE 5.090 . 5.850 3.952 2.789 4.829 . 0 0 "[ . 1 . 2]" 1
467 1 25 LYS HB2 1 92 TYR QE 3.660 . 4.210 3.301 2.077 4.204 . 0 0 "[ . 1 . 2]" 1
468 1 25 LYS HB3 1 26 VAL H 3.340 . 3.840 2.595 2.261 3.154 . 0 0 "[ . 1 . 2]" 1
469 1 25 LYS HB3 1 92 TYR QE 5.210 . 5.990 4.833 3.734 5.719 . 0 0 "[ . 1 . 2]" 1
470 1 25 LYS HE2 1 29 ASN HD21 5.500 . 6.330 5.093 3.204 6.407 0.077 20 0 "[ . 1 . 2]" 1
471 1 25 LYS HE2 1 29 ASN HD22 5.500 . 6.330 3.971 1.852 5.645 . 0 0 "[ . 1 . 2]" 1
472 1 25 LYS HE3 1 29 ASN HD21 5.500 . 6.330 5.204 3.737 6.428 0.098 8 0 "[ . 1 . 2]" 1
473 1 25 LYS HE3 1 29 ASN HD22 5.500 . 6.330 4.080 2.124 5.503 . 0 0 "[ . 1 . 2]" 1
474 1 25 LYS QG 1 26 VAL H 4.400 . 5.060 3.766 3.147 4.408 . 0 0 "[ . 1 . 2]" 1
475 1 25 LYS HG2 1 29 ASN HD22 4.280 . 4.920 3.392 2.167 4.944 0.024 10 0 "[ . 1 . 2]" 1
476 1 25 LYS HG3 1 29 ASN HD22 4.280 . 4.920 3.298 1.860 4.656 . 0 0 "[ . 1 . 2]" 1
477 1 26 VAL H 1 26 VAL HB 2.970 . 3.420 2.551 2.468 2.594 . 0 0 "[ . 1 . 2]" 1
478 1 26 VAL H 1 26 VAL MG1 3.780 . 4.350 3.789 3.773 3.801 . 0 0 "[ . 1 . 2]" 1
479 1 26 VAL H 1 26 VAL MG2 3.040 . 3.500 2.100 1.991 2.225 . 0 0 "[ . 1 . 2]" 1
480 1 26 VAL H 1 27 MET H 3.410 . 3.920 2.931 2.742 3.100 . 0 0 "[ . 1 . 2]" 1
481 1 26 VAL H 1 29 ASN H 5.290 . 6.080 4.766 4.642 5.039 . 0 0 "[ . 1 . 2]" 1
482 1 26 VAL HA 1 26 VAL MG1 3.180 . 3.660 2.442 2.381 2.478 . 0 0 "[ . 1 . 2]" 1
483 1 26 VAL HA 1 26 VAL MG2 2.940 . 3.380 2.371 2.342 2.403 . 0 0 "[ . 1 . 2]" 1
484 1 26 VAL HA 1 29 ASN H 3.830 . 4.400 3.628 3.265 3.872 . 0 0 "[ . 1 . 2]" 1
485 1 26 VAL HA 1 29 ASN HB2 4.190 . 4.820 3.074 2.553 3.389 . 0 0 "[ . 1 . 2]" 1
486 1 26 VAL HA 1 29 ASN HB3 4.240 . 4.880 4.723 4.232 4.920 0.040 15 0 "[ . 1 . 2]" 1
487 1 26 VAL HA 1 29 ASN HD21 4.830 . 5.550 4.331 1.918 5.307 . 0 0 "[ . 1 . 2]" 1
488 1 26 VAL HA 1 29 ASN HD22 5.360 . 6.160 5.163 3.107 5.770 . 0 0 "[ . 1 . 2]" 1
489 1 26 VAL HB 1 27 MET H 3.080 . 3.540 2.372 2.246 2.728 . 0 0 "[ . 1 . 2]" 1
490 1 26 VAL MG1 1 27 MET H 3.730 . 4.290 3.112 2.903 3.508 . 0 0 "[ . 1 . 2]" 1
491 1 26 VAL MG1 1 27 MET HA 4.260 . 4.900 3.260 3.131 3.633 . 0 0 "[ . 1 . 2]" 1
492 1 26 VAL MG1 1 29 ASN H 4.600 . 5.290 4.758 4.447 5.023 . 0 0 "[ . 1 . 2]" 1
493 1 26 VAL MG1 1 29 ASN HB2 5.180 . 5.960 4.253 3.572 4.575 . 0 0 "[ . 1 . 2]" 1
494 1 26 VAL MG1 1 29 ASN HB3 5.030 . 5.780 5.447 4.841 5.783 0.003 11 0 "[ . 1 . 2]" 1
495 1 26 VAL MG1 1 29 ASN HD21 5.500 . 6.330 5.811 3.822 6.457 0.127 8 0 "[ . 1 . 2]" 1
496 1 26 VAL MG1 1 30 ARG QB 3.860 . 4.440 3.717 2.986 4.509 0.069 12 0 "[ . 1 . 2]" 1
497 1 26 VAL MG2 1 27 MET H 3.910 . 4.500 3.806 3.719 3.908 . 0 0 "[ . 1 . 2]" 1
498 1 26 VAL MG2 1 29 ASN H 5.500 . 6.330 5.324 5.066 5.550 . 0 0 "[ . 1 . 2]" 1
499 1 26 VAL MG2 1 29 ASN HB2 5.500 . 6.330 4.846 4.275 5.126 . 0 0 "[ . 1 . 2]" 1
500 1 26 VAL MG2 1 29 ASN HB3 5.500 . 6.330 6.119 5.497 6.348 0.018 15 0 "[ . 1 . 2]" 1
501 1 27 MET H 1 27 MET HB2 3.600 . 4.140 3.573 2.639 3.642 . 0 0 "[ . 1 . 2]" 1
502 1 27 MET H 1 27 MET HB3 3.600 . 4.140 2.643 2.464 3.644 . 0 0 "[ . 1 . 2]" 1
503 1 27 MET H 1 27 MET HG2 4.660 . 5.360 2.211 1.796 3.106 0.004 14 0 "[ . 1 . 2]" 1
504 1 27 MET H 1 27 MET QG 4.060 . 4.670 2.141 1.783 2.356 0.017 14 0 "[ . 1 . 2]" 1
505 1 27 MET H 1 27 MET HG3 4.660 . 5.360 3.316 2.228 3.652 . 0 0 "[ . 1 . 2]" 1
506 1 27 MET H 1 28 LEU H 3.530 . 4.060 2.700 2.549 2.812 . 0 0 "[ . 1 . 2]" 1
507 1 27 MET H 1 28 LEU HB2 5.380 . 6.190 5.009 4.804 5.146 . 0 0 "[ . 1 . 2]" 1
508 1 27 MET H 1 29 ASN H 4.420 . 5.080 4.308 3.973 4.501 . 0 0 "[ . 1 . 2]" 1
509 1 27 MET H 1 29 ASN HB2 5.500 . 6.330 5.467 5.282 5.660 . 0 0 "[ . 1 . 2]" 1
510 1 27 MET H 1 30 ARG QB 5.190 . 5.970 4.678 4.279 5.304 . 0 0 "[ . 1 . 2]" 1
511 1 27 MET H 1 78 PHE HZ 5.380 . 6.190 4.985 4.363 5.425 . 0 0 "[ . 1 . 2]" 1
512 1 27 MET HA 1 27 MET QG 3.520 . 4.050 3.312 2.454 3.370 . 0 0 "[ . 1 . 2]" 1
513 1 27 MET HA 1 30 ARG H 4.060 . 4.670 3.262 2.815 3.741 . 0 0 "[ . 1 . 2]" 1
514 1 27 MET HA 1 30 ARG QB 3.790 . 4.360 2.375 2.001 2.878 . 0 0 "[ . 1 . 2]" 1
515 1 27 MET HA 1 30 ARG HG2 5.400 . 6.210 4.256 2.464 5.153 . 0 0 "[ . 1 . 2]" 1
516 1 27 MET HA 1 30 ARG QG 4.610 . 5.300 3.698 2.299 4.592 . 0 0 "[ . 1 . 2]" 1
517 1 27 MET HA 1 30 ARG HG3 5.400 . 6.210 4.362 2.751 5.447 . 0 0 "[ . 1 . 2]" 1
518 1 27 MET HA 1 78 PHE HZ 4.970 . 5.720 5.610 5.042 5.764 0.044 5 0 "[ . 1 . 2]" 1
519 1 27 MET QB 1 28 LEU H 3.780 . 4.350 3.439 2.353 3.606 . 0 0 "[ . 1 . 2]" 1
520 1 27 MET QB 1 78 PHE HZ 4.620 . 5.310 4.137 2.446 4.516 . 0 0 "[ . 1 . 2]" 1
521 1 27 MET HB2 1 28 LEU H 4.620 . 5.310 3.774 2.389 4.024 . 0 0 "[ . 1 . 2]" 1
522 1 27 MET HB3 1 28 LEU H 4.620 . 5.310 4.002 3.541 4.122 . 0 0 "[ . 1 . 2]" 1
523 1 27 MET ME 1 27 MET QG 3.210 . 3.690 2.294 2.237 2.498 . 0 0 "[ . 1 . 2]" 1
524 1 27 MET ME 1 41 ASP HA 3.740 . 4.300 3.638 2.606 4.356 0.056 19 0 "[ . 1 . 2]" 1
525 1 27 MET ME 1 41 ASP QB 3.660 . 4.210 2.942 2.041 3.705 . 0 0 "[ . 1 . 2]" 1
526 1 27 MET ME 1 44 PHE HB2 4.600 . 5.290 4.378 3.501 4.847 . 0 0 "[ . 1 . 2]" 1
527 1 27 MET ME 1 44 PHE HB3 3.390 . 3.900 3.144 2.281 3.603 . 0 0 "[ . 1 . 2]" 1
528 1 27 MET ME 1 44 PHE QD 3.160 . 3.630 2.559 1.959 3.274 . 0 0 "[ . 1 . 2]" 1
529 1 27 MET ME 1 45 LEU H 4.660 . 5.360 4.023 3.395 4.471 . 0 0 "[ . 1 . 2]" 1
530 1 27 MET ME 1 45 LEU QD 3.820 . 4.370 2.297 2.004 2.865 . 0 0 "[ . 1 . 2]" 1
531 1 27 MET ME 1 45 LEU HG 3.880 . 4.460 2.779 2.357 3.294 . 0 0 "[ . 1 . 2]" 1
532 1 27 MET ME 1 78 PHE HE1 4.890 . 5.620 3.367 2.474 3.963 . 0 0 "[ . 1 . 2]" 1
533 1 27 MET QG 1 28 LEU H 4.550 . 5.230 2.357 2.087 3.863 . 0 0 "[ . 1 . 2]" 1
534 1 27 MET QG 1 29 ASN H 5.340 . 6.140 4.662 4.414 5.679 . 0 0 "[ . 1 . 2]" 1
535 1 27 MET QG 1 78 PHE HZ 3.770 . 4.340 2.338 1.786 4.390 0.050 8 0 "[ . 1 . 2]" 1
536 1 27 MET HG2 1 31 TYR QD 5.500 . 6.330 5.653 4.807 6.270 . 0 0 "[ . 1 . 2]" 1
537 1 27 MET HG3 1 31 TYR QD 5.500 . 6.330 4.360 3.287 6.280 . 0 0 "[ . 1 . 2]" 1
538 1 28 LEU H 1 28 LEU HB2 3.220 . 3.700 2.479 2.338 2.550 . 0 0 "[ . 1 . 2]" 1
539 1 28 LEU H 1 28 LEU HB3 3.140 . 3.610 2.507 2.399 2.635 . 0 0 "[ . 1 . 2]" 1
540 1 28 LEU H 1 28 LEU MD1 4.250 . 4.890 4.085 3.942 4.145 . 0 0 "[ . 1 . 2]" 1
541 1 28 LEU H 1 28 LEU MD2 4.440 . 5.110 4.238 4.190 4.274 . 0 0 "[ . 1 . 2]" 1
542 1 28 LEU H 1 29 ASN H 3.410 . 3.920 2.767 2.574 2.917 . 0 0 "[ . 1 . 2]" 1
543 1 28 LEU H 1 29 ASN HB2 5.010 . 5.760 4.879 4.756 5.115 . 0 0 "[ . 1 . 2]" 1
544 1 28 LEU H 1 30 ARG H 4.720 . 5.430 3.920 3.720 4.209 . 0 0 "[ . 1 . 2]" 1
545 1 28 LEU H 1 78 PHE HZ 3.720 . 4.280 3.053 2.386 3.315 . 0 0 "[ . 1 . 2]" 1
546 1 28 LEU HA 1 28 LEU MD1 3.260 . 3.750 2.109 2.028 2.165 . 0 0 "[ . 1 . 2]" 1
547 1 28 LEU HA 1 30 ARG H 4.600 . 5.290 4.037 3.709 4.399 . 0 0 "[ . 1 . 2]" 1
548 1 28 LEU HA 1 31 TYR H 4.520 . 5.200 3.716 3.302 3.928 . 0 0 "[ . 1 . 2]" 1
549 1 28 LEU HA 1 31 TYR QD 4.020 . 4.620 3.004 2.195 3.954 . 0 0 "[ . 1 . 2]" 1
550 1 28 LEU HA 1 68 VAL MG2 3.690 . 4.240 3.244 2.713 3.816 . 0 0 "[ . 1 . 2]" 1
551 1 28 LEU HA 1 78 PHE HE1 5.190 . 5.970 3.308 3.140 3.561 . 0 0 "[ . 1 . 2]" 1
552 1 28 LEU HA 1 78 PHE HZ 3.540 . 4.070 2.984 2.624 3.228 . 0 0 "[ . 1 . 2]" 1
553 1 28 LEU HB2 1 29 ASN H 4.150 . 4.770 3.849 3.687 4.125 . 0 0 "[ . 1 . 2]" 1
554 1 28 LEU HB2 1 78 PHE HD1 5.400 . 6.210 5.531 5.243 5.849 . 0 0 "[ . 1 . 2]" 1
555 1 28 LEU HB2 1 78 PHE HD2 4.800 . 5.520 4.704 4.338 4.884 . 0 0 "[ . 1 . 2]" 1
556 1 28 LEU HB2 1 78 PHE HZ 4.170 . 4.800 2.295 2.178 2.468 . 0 0 "[ . 1 . 2]" 1
557 1 28 LEU HB3 1 29 ASN H 3.410 . 3.920 2.542 2.332 3.086 . 0 0 "[ . 1 . 2]" 1
558 1 28 LEU HB3 1 29 ASN HB2 5.190 . 5.970 4.616 4.346 5.112 . 0 0 "[ . 1 . 2]" 1
559 1 28 LEU HB3 1 29 ASN HD22 4.960 . 5.700 3.768 3.305 5.634 . 0 0 "[ . 1 . 2]" 1
560 1 28 LEU HB3 1 78 PHE HD2 5.500 . 6.330 6.201 5.825 6.399 0.069 13 0 "[ . 1 . 2]" 1
561 1 28 LEU HB3 1 78 PHE HZ 4.660 . 5.360 3.903 3.833 4.016 . 0 0 "[ . 1 . 2]" 1
562 1 28 LEU MD1 1 29 ASN H 4.660 . 5.360 4.471 4.314 4.708 . 0 0 "[ . 1 . 2]" 1
563 1 28 LEU MD1 1 29 ASN HA 5.200 . 5.980 4.767 4.535 5.088 . 0 0 "[ . 1 . 2]" 1
564 1 28 LEU MD1 1 31 TYR QD 5.500 . 6.330 4.114 3.233 4.986 . 0 0 "[ . 1 . 2]" 1
565 1 28 LEU MD1 1 68 VAL MG1 3.000 . 3.450 1.932 1.795 2.214 0.005 19 0 "[ . 1 . 2]" 1
566 1 28 LEU MD1 1 68 VAL MG2 3.170 . 3.650 2.436 2.091 3.145 . 0 0 "[ . 1 . 2]" 1
567 1 28 LEU MD1 1 69 ARG H 4.760 . 5.470 4.052 3.676 4.593 . 0 0 "[ . 1 . 2]" 1
568 1 28 LEU MD1 1 76 GLN H 5.200 . 5.980 4.519 3.034 5.325 . 0 0 "[ . 1 . 2]" 1
569 1 28 LEU MD1 1 76 GLN QB 4.710 . 5.420 2.120 1.785 2.545 0.015 13 0 "[ . 1 . 2]" 1
570 1 28 LEU MD1 1 76 GLN HE21 3.860 . 4.440 3.508 2.410 3.902 . 0 0 "[ . 1 . 2]" 1
571 1 28 LEU MD1 1 76 GLN HE22 4.650 . 5.350 3.921 3.380 4.378 . 0 0 "[ . 1 . 2]" 1
572 1 28 LEU MD1 1 76 GLN HG2 4.060 . 4.670 4.180 3.556 4.467 . 0 0 "[ . 1 . 2]" 1
573 1 28 LEU MD1 1 76 GLN HG3 4.920 . 5.660 4.642 4.344 5.043 . 0 0 "[ . 1 . 2]" 1
574 1 28 LEU MD1 1 77 CYS H 4.460 . 5.130 3.066 2.610 3.471 . 0 0 "[ . 1 . 2]" 1
575 1 28 LEU MD1 1 77 CYS HA 3.950 . 4.540 3.215 2.747 3.820 . 0 0 "[ . 1 . 2]" 1
576 1 28 LEU MD1 1 78 PHE H 5.120 . 5.890 3.670 3.243 4.040 . 0 0 "[ . 1 . 2]" 1
577 1 28 LEU MD1 1 78 PHE QB 4.730 . 5.440 4.136 3.868 4.342 . 0 0 "[ . 1 . 2]" 1
578 1 28 LEU MD1 1 78 PHE HD1 3.920 . 4.510 3.582 3.217 3.939 . 0 0 "[ . 1 . 2]" 1
579 1 28 LEU MD1 1 78 PHE HZ 3.790 . 4.360 3.053 2.846 3.321 . 0 0 "[ . 1 . 2]" 1
580 1 28 LEU MD2 1 29 ASN H 4.640 . 5.340 4.247 3.982 4.765 . 0 0 "[ . 1 . 2]" 1
581 1 28 LEU MD2 1 29 ASN HA 5.030 . 5.780 4.887 4.705 5.260 . 0 0 "[ . 1 . 2]" 1
582 1 28 LEU MD2 1 29 ASN HD22 4.750 . 5.460 3.548 2.996 5.385 . 0 0 "[ . 1 . 2]" 1
583 1 28 LEU MD2 1 76 GLN H 4.480 . 5.150 3.173 2.399 3.831 . 0 0 "[ . 1 . 2]" 1
584 1 28 LEU MD2 1 76 GLN QB 4.200 . 4.830 2.242 1.794 3.503 0.006 11 0 "[ . 1 . 2]" 1
585 1 28 LEU MD2 1 76 GLN HE21 4.500 . 5.180 4.780 3.765 5.193 0.013 18 0 "[ . 1 . 2]" 1
586 1 28 LEU MD2 1 76 GLN HE22 5.500 . 6.330 4.934 3.839 5.463 . 0 0 "[ . 1 . 2]" 1
587 1 28 LEU MD2 1 76 GLN HG2 5.040 . 5.800 4.756 4.417 5.676 . 0 0 "[ . 1 . 2]" 1
588 1 28 LEU MD2 1 76 GLN HG3 4.910 . 5.650 4.421 3.861 5.529 . 0 0 "[ . 1 . 2]" 1
589 1 28 LEU MD2 1 77 CYS HA 3.900 . 4.490 2.965 2.354 3.716 . 0 0 "[ . 1 . 2]" 1
590 1 28 LEU MD2 1 77 CYS HB2 5.040 . 5.800 4.995 4.135 5.817 0.017 11 0 "[ . 1 . 2]" 1
591 1 28 LEU MD2 1 77 CYS QB 4.350 . 5.000 4.465 3.899 4.968 . 0 0 "[ . 1 . 2]" 1
592 1 28 LEU MD2 1 77 CYS HB3 5.040 . 5.800 5.095 4.433 5.633 . 0 0 "[ . 1 . 2]" 1
593 1 28 LEU MD2 1 78 PHE H 5.120 . 5.890 4.122 3.416 4.680 . 0 0 "[ . 1 . 2]" 1
594 1 28 LEU MD2 1 78 PHE QB 4.720 . 5.430 5.046 4.556 5.435 0.005 14 0 "[ . 1 . 2]" 1
595 1 28 LEU MD2 1 78 PHE HD2 4.370 . 5.030 3.829 3.438 4.148 . 0 0 "[ . 1 . 2]" 1
596 1 28 LEU MD2 1 78 PHE HZ 5.040 . 5.800 3.981 3.659 4.268 . 0 0 "[ . 1 . 2]" 1
597 1 28 LEU MD2 1 92 TYR QD 4.400 . 5.060 4.134 3.435 4.832 . 0 0 "[ . 1 . 2]" 1
598 1 28 LEU MD2 1 92 TYR QE 3.070 . 3.530 2.613 1.993 3.488 . 0 0 "[ . 1 . 2]" 1
599 1 28 LEU HG 1 29 ASN HA 4.390 . 5.050 3.809 3.558 4.224 . 0 0 "[ . 1 . 2]" 1
600 1 28 LEU HG 1 76 GLN HE21 3.660 . 4.210 3.704 2.450 4.099 . 0 0 "[ . 1 . 2]" 1
601 1 28 LEU HG 1 76 GLN HE22 4.100 . 4.720 3.603 2.890 4.136 . 0 0 "[ . 1 . 2]" 1
602 1 29 ASN H 1 29 ASN HB2 3.100 . 3.570 2.378 2.294 2.536 . 0 0 "[ . 1 . 2]" 1
603 1 29 ASN H 1 29 ASN HB3 3.540 . 4.070 3.595 3.561 3.647 . 0 0 "[ . 1 . 2]" 1
604 1 29 ASN H 1 30 ARG QB 4.500 . 5.180 4.307 3.951 4.747 . 0 0 "[ . 1 . 2]" 1
605 1 29 ASN H 1 68 VAL MG1 5.500 . 6.330 5.522 4.860 6.111 . 0 0 "[ . 1 . 2]" 1
606 1 29 ASN H 1 76 GLN HE21 5.280 . 6.070 5.975 5.132 6.133 0.063 5 0 "[ . 1 . 2]" 1
607 1 29 ASN HA 1 31 TYR H 4.680 . 5.380 4.077 3.576 4.457 . 0 0 "[ . 1 . 2]" 1
608 1 29 ASN HA 1 76 GLN HE21 3.810 . 4.380 4.172 3.532 4.412 0.032 5 0 "[ . 1 . 2]" 1
609 1 29 ASN HA 1 76 GLN HE22 3.590 . 4.130 2.729 2.361 3.055 . 0 0 "[ . 1 . 2]" 1
610 1 29 ASN HB2 1 30 ARG H 4.020 . 4.620 3.241 2.826 3.762 . 0 0 "[ . 1 . 2]" 1
611 1 29 ASN HB2 1 76 GLN HE22 5.500 . 6.330 5.653 5.273 5.995 . 0 0 "[ . 1 . 2]" 1
612 1 29 ASN HB3 1 30 ARG H 3.870 . 4.450 3.988 3.729 4.311 . 0 0 "[ . 1 . 2]" 1
613 1 29 ASN HB3 1 76 GLN HE22 5.440 . 6.260 5.115 4.830 5.411 . 0 0 "[ . 1 . 2]" 1
614 1 30 ARG H 1 30 ARG HB2 3.690 . 4.240 2.499 2.146 2.807 . 0 0 "[ . 1 . 2]" 1
615 1 30 ARG H 1 30 ARG QB 2.880 . 3.310 2.247 2.119 2.456 . 0 0 "[ . 1 . 2]" 1
616 1 30 ARG H 1 30 ARG HB3 3.690 . 4.240 2.768 2.292 3.615 . 0 0 "[ . 1 . 2]" 1
617 1 30 ARG H 1 30 ARG QD 5.030 . 5.780 3.967 2.357 4.612 . 0 0 "[ . 1 . 2]" 1
618 1 30 ARG H 1 30 ARG HG2 4.660 . 5.360 4.326 2.278 4.665 . 0 0 "[ . 1 . 2]" 1
619 1 30 ARG H 1 30 ARG QG 3.990 . 4.590 3.873 2.259 4.053 . 0 0 "[ . 1 . 2]" 1
620 1 30 ARG H 1 30 ARG HG3 4.660 . 5.360 4.427 3.721 4.659 . 0 0 "[ . 1 . 2]" 1
621 1 30 ARG H 1 31 TYR H 2.890 . 3.320 2.531 2.152 2.703 . 0 0 "[ . 1 . 2]" 1
622 1 30 ARG HA 1 30 ARG QG 3.600 . 4.140 2.624 2.373 3.136 . 0 0 "[ . 1 . 2]" 1
623 1 30 ARG QB 1 30 ARG QD 3.120 . 3.590 2.323 2.135 2.418 . 0 0 "[ . 1 . 2]" 1
624 1 30 ARG QB 1 30 ARG QG 2.210 . 2.540 2.017 1.996 2.094 . 0 0 "[ . 1 . 2]" 1
625 1 30 ARG QB 1 31 TYR H 3.600 . 4.140 2.772 2.406 3.307 . 0 0 "[ . 1 . 2]" 1
626 1 30 ARG QB 1 31 TYR QD 5.340 . 6.140 3.407 2.881 3.914 . 0 0 "[ . 1 . 2]" 1
627 1 30 ARG QB 1 31 TYR HE2 5.340 . 6.140 4.168 3.179 5.917 . 0 0 "[ . 1 . 2]" 1
628 1 30 ARG HB2 1 30 ARG HD2 4.100 . 4.720 3.282 2.552 4.054 . 0 0 "[ . 1 . 2]" 1
629 1 30 ARG HB2 1 30 ARG HD3 4.100 . 4.720 3.193 2.528 3.860 . 0 0 "[ . 1 . 2]" 1
630 1 30 ARG HB2 1 31 TYR H 4.190 . 4.820 3.765 3.030 4.168 . 0 0 "[ . 1 . 2]" 1
631 1 30 ARG HB3 1 30 ARG HD2 4.100 . 4.720 3.099 2.302 3.757 . 0 0 "[ . 1 . 2]" 1
632 1 30 ARG HB3 1 30 ARG HD3 4.100 . 4.720 3.271 2.262 3.798 . 0 0 "[ . 1 . 2]" 1
633 1 30 ARG HB3 1 31 TYR H 4.190 . 4.820 2.978 2.431 3.979 . 0 0 "[ . 1 . 2]" 1
634 1 30 ARG QD 1 31 TYR H 4.350 . 5.000 4.129 3.077 4.775 . 0 0 "[ . 1 . 2]" 1
635 1 30 ARG HD2 1 31 TYR H 5.100 . 5.870 4.705 3.717 5.883 0.013 5 0 "[ . 1 . 2]" 1
636 1 30 ARG HD3 1 31 TYR H 5.100 . 5.870 4.772 3.182 5.916 0.046 14 0 "[ . 1 . 2]" 1
637 1 30 ARG QG 1 31 TYR H 5.190 . 5.970 4.159 3.240 4.894 . 0 0 "[ . 1 . 2]" 1
638 1 31 TYR H 1 31 TYR HB2 3.330 . 3.830 2.501 2.391 2.590 . 0 0 "[ . 1 . 2]" 1
639 1 31 TYR H 1 31 TYR HB3 3.670 . 4.220 3.666 3.600 3.737 . 0 0 "[ . 1 . 2]" 1
640 1 31 TYR H 1 31 TYR QD 3.970 . 4.570 2.629 2.268 2.965 . 0 0 "[ . 1 . 2]" 1
641 1 31 TYR H 1 31 TYR HE2 5.500 . 6.330 4.863 4.372 6.172 . 0 0 "[ . 1 . 2]" 1
642 1 31 TYR H 1 32 ARG H 4.780 . 5.500 4.553 4.349 4.622 . 0 0 "[ . 1 . 2]" 1
643 1 31 TYR H 1 68 VAL MG2 4.360 . 5.010 4.019 3.608 4.541 . 0 0 "[ . 1 . 2]" 1
644 1 31 TYR H 1 76 GLN HE21 5.500 . 6.330 5.117 4.255 5.903 . 0 0 "[ . 1 . 2]" 1
645 1 31 TYR HA 1 31 TYR QD 3.730 . 4.290 2.844 2.553 3.060 . 0 0 "[ . 1 . 2]" 1
646 1 31 TYR HA 1 32 ARG H 3.130 . 3.600 2.323 2.136 2.550 . 0 0 "[ . 1 . 2]" 1
647 1 31 TYR HB2 1 32 ARG H 4.300 . 4.950 3.821 3.370 4.411 . 0 0 "[ . 1 . 2]" 1
648 1 31 TYR HB2 1 37 VAL QG 4.420 . 5.080 4.067 3.432 4.671 . 0 0 "[ . 1 . 2]" 1
649 1 31 TYR HB2 1 68 VAL HB 4.800 . 5.520 3.324 2.665 4.100 . 0 0 "[ . 1 . 2]" 1
650 1 31 TYR HB2 1 68 VAL MG1 4.080 . 4.690 2.628 2.072 3.561 . 0 0 "[ . 1 . 2]" 1
651 1 31 TYR HB2 1 68 VAL MG2 3.440 . 3.960 1.966 1.752 2.492 0.048 2 0 "[ . 1 . 2]" 1
652 1 31 TYR HB3 1 32 ARG H 3.310 . 3.810 2.737 2.140 3.638 . 0 0 "[ . 1 . 2]" 1
653 1 31 TYR HB3 1 35 ASP H 5.010 . 5.760 4.095 3.687 4.729 . 0 0 "[ . 1 . 2]" 1
654 1 31 TYR HB3 1 37 VAL QG 4.320 . 4.970 4.267 3.510 4.803 . 0 0 "[ . 1 . 2]" 1
655 1 31 TYR HB3 1 68 VAL HB 3.920 . 4.510 3.026 2.401 3.573 . 0 0 "[ . 1 . 2]" 1
656 1 31 TYR HB3 1 68 VAL MG2 3.630 . 4.170 2.638 2.077 3.076 . 0 0 "[ . 1 . 2]" 1
657 1 31 TYR QD 1 32 ARG H 3.740 . 4.300 3.861 3.515 4.231 . 0 0 "[ . 1 . 2]" 1
658 1 31 TYR QD 1 35 ASP HB2 3.900 . 4.490 3.080 2.503 3.981 . 0 0 "[ . 1 . 2]" 1
659 1 31 TYR QD 1 35 ASP HB3 3.730 . 4.290 2.704 1.881 4.151 . 0 0 "[ . 1 . 2]" 1
660 1 31 TYR QD 1 36 ILE H 5.470 . 6.290 4.671 4.103 5.107 . 0 0 "[ . 1 . 2]" 1
661 1 31 TYR QD 1 37 VAL QG 4.630 . 5.320 3.430 3.054 3.817 . 0 0 "[ . 1 . 2]" 1
662 1 31 TYR QD 1 38 SER H 5.140 . 5.910 4.725 4.216 5.265 . 0 0 "[ . 1 . 2]" 1
663 1 31 TYR QD 1 68 VAL MG1 5.500 . 6.330 4.133 3.659 4.987 . 0 0 "[ . 1 . 2]" 1
664 1 31 TYR QD 1 68 VAL MG2 4.060 . 4.670 2.879 2.268 3.532 . 0 0 "[ . 1 . 2]" 1
665 1 31 TYR QD 1 78 PHE HZ 4.390 . 5.050 4.747 4.055 5.057 0.007 2 0 "[ . 1 . 2]" 1
666 1 31 TYR HE1 1 37 VAL HA 4.270 . 4.910 3.372 2.801 4.294 . 0 0 "[ . 1 . 2]" 1
667 1 31 TYR HE1 1 38 SER H 5.070 . 5.830 3.305 2.654 4.311 . 0 0 "[ . 1 . 2]" 1
668 1 31 TYR HE2 1 37 VAL HA 4.520 . 5.200 4.055 3.416 4.681 . 0 0 "[ . 1 . 2]" 1
669 1 31 TYR HE2 1 37 VAL QG 4.290 . 4.930 3.139 2.424 4.538 . 0 0 "[ . 1 . 2]" 1
670 1 31 TYR HE2 1 38 SER H 3.650 . 4.200 3.993 3.164 4.226 0.026 7 0 "[ . 1 . 2]" 1
671 1 31 TYR HE2 1 41 ASP QB 4.860 . 5.590 3.611 2.873 5.506 . 0 0 "[ . 1 . 2]" 1
672 1 32 ARG H 1 32 ARG HB2 3.440 . 3.960 2.500 2.359 2.658 . 0 0 "[ . 1 . 2]" 1
673 1 32 ARG H 1 32 ARG HB3 4.070 . 4.680 3.656 3.583 3.770 . 0 0 "[ . 1 . 2]" 1
674 1 32 ARG H 1 32 ARG HG2 4.650 . 5.350 3.895 3.309 4.292 . 0 0 "[ . 1 . 2]" 1
675 1 32 ARG H 1 32 ARG QG 4.020 . 4.620 2.802 2.081 3.600 . 0 0 "[ . 1 . 2]" 1
676 1 32 ARG H 1 32 ARG HG3 4.650 . 5.350 2.917 2.104 3.873 . 0 0 "[ . 1 . 2]" 1
677 1 32 ARG H 1 33 PRO HD2 4.950 . 5.690 5.082 4.742 5.357 . 0 0 "[ . 1 . 2]" 1
678 1 32 ARG H 1 35 ASP H 4.780 . 5.500 3.893 3.298 4.504 . 0 0 "[ . 1 . 2]" 1
679 1 32 ARG H 1 35 ASP HB2 4.400 . 5.060 2.584 2.025 2.981 . 0 0 "[ . 1 . 2]" 1
680 1 32 ARG H 1 68 VAL MG2 5.250 . 6.040 4.730 4.137 5.328 . 0 0 "[ . 1 . 2]" 1
681 1 32 ARG HA 1 32 ARG QD 4.180 . 4.810 3.810 2.836 4.263 . 0 0 "[ . 1 . 2]" 1
682 1 32 ARG HA 1 32 ARG QG 3.600 . 4.140 2.495 2.406 2.634 . 0 0 "[ . 1 . 2]" 1
683 1 32 ARG HA 1 33 PRO HD2 3.310 . 3.810 2.858 2.403 3.207 . 0 0 "[ . 1 . 2]" 1
684 1 32 ARG HA 1 33 PRO HD3 3.410 . 3.920 2.220 1.858 2.654 . 0 0 "[ . 1 . 2]" 1
685 1 32 ARG HA 1 33 PRO QG 4.530 . 5.210 3.968 3.700 4.245 . 0 0 "[ . 1 . 2]" 1
686 1 32 ARG HA 1 34 GLY H 4.110 . 4.730 4.447 4.092 4.873 0.143 16 0 "[ . 1 . 2]" 1
687 1 32 ARG HA 1 76 GLN HE21 5.290 . 6.080 3.748 3.154 4.812 . 0 0 "[ . 1 . 2]" 1
688 1 32 ARG HA 1 76 GLN HE22 4.350 . 5.000 3.659 3.038 4.953 . 0 0 "[ . 1 . 2]" 1
689 1 32 ARG HB2 1 32 ARG QD 3.500 . 4.030 2.572 2.226 2.904 . 0 0 "[ . 1 . 2]" 1
690 1 32 ARG HB2 1 33 PRO HD2 3.770 . 4.340 3.668 3.308 4.126 . 0 0 "[ . 1 . 2]" 1
691 1 32 ARG HB3 1 33 PRO HD2 3.740 . 4.300 2.116 1.772 2.639 0.028 1 0 "[ . 1 . 2]" 1
692 1 32 ARG HB3 1 33 PRO HD3 3.690 . 4.240 3.093 2.698 3.505 . 0 0 "[ . 1 . 2]" 1
693 1 32 ARG HB3 1 35 ASP H 4.600 . 5.290 4.853 4.485 5.323 0.033 8 0 "[ . 1 . 2]" 1
694 1 32 ARG QG 1 33 PRO HD2 4.380 . 5.040 3.584 3.073 4.037 . 0 0 "[ . 1 . 2]" 1
695 1 32 ARG QG 1 33 PRO HD3 4.050 . 4.660 3.804 3.403 4.372 . 0 0 "[ . 1 . 2]" 1
696 1 32 ARG HG2 1 33 PRO HD2 5.230 . 6.010 3.916 3.345 4.371 . 0 0 "[ . 1 . 2]" 1
697 1 32 ARG HG3 1 33 PRO HD2 5.230 . 6.010 4.410 3.245 5.261 . 0 0 "[ . 1 . 2]" 1
698 1 33 PRO HA 1 34 GLY H 3.480 . 4.000 2.810 2.323 3.389 . 0 0 "[ . 1 . 2]" 1
699 1 33 PRO HA 1 35 ASP H 4.420 . 5.080 4.090 3.869 4.356 . 0 0 "[ . 1 . 2]" 1
700 1 33 PRO HA 1 68 VAL MG1 3.610 . 4.150 2.601 1.830 3.417 . 0 0 "[ . 1 . 2]" 1
701 1 33 PRO HA 1 69 ARG HA 3.870 . 4.450 2.525 1.920 3.449 . 0 0 "[ . 1 . 2]" 1
702 1 33 PRO QB 1 34 GLY H 4.080 . 4.690 3.846 3.373 4.013 . 0 0 "[ . 1 . 2]" 1
703 1 33 PRO QB 1 69 ARG HA 4.470 . 5.140 2.981 2.464 3.858 . 0 0 "[ . 1 . 2]" 1
704 1 33 PRO QB 1 70 SER H 4.050 . 4.660 2.781 1.917 3.446 . 0 0 "[ . 1 . 2]" 1
705 1 33 PRO HD2 1 68 VAL MG1 5.210 . 5.990 5.118 4.600 5.743 . 0 0 "[ . 1 . 2]" 1
706 1 33 PRO QG 1 69 ARG HA 5.350 . 6.150 4.568 3.391 5.650 . 0 0 "[ . 1 . 2]" 1
707 1 33 PRO HG2 1 34 GLY H 4.770 . 5.490 5.054 3.815 5.740 0.250 15 0 "[ . 1 . 2]" 1
708 1 33 PRO HG3 1 34 GLY H 4.770 . 5.490 5.206 4.973 5.728 0.238 2 0 "[ . 1 . 2]" 1
709 1 34 GLY H 1 35 ASP H 3.260 . 3.750 1.959 1.775 2.248 0.025 10 0 "[ . 1 . 2]" 1
710 1 34 GLY H 1 68 VAL H 5.500 . 6.330 4.762 3.633 5.999 . 0 0 "[ . 1 . 2]" 1
711 1 34 GLY H 1 68 VAL HB 4.830 . 5.550 3.751 2.897 5.396 . 0 0 "[ . 1 . 2]" 1
712 1 34 GLY H 1 68 VAL MG1 4.920 . 5.660 3.949 3.429 5.246 . 0 0 "[ . 1 . 2]" 1
713 1 35 ASP H 1 35 ASP HB2 3.130 . 3.600 2.454 2.268 2.732 . 0 0 "[ . 1 . 2]" 1
714 1 35 ASP H 1 35 ASP HB3 3.760 . 4.320 3.661 3.542 3.838 . 0 0 "[ . 1 . 2]" 1
715 1 35 ASP H 1 68 VAL H 4.050 . 4.660 3.863 3.185 4.395 . 0 0 "[ . 1 . 2]" 1
716 1 35 ASP H 1 68 VAL HB 3.740 . 4.300 3.202 2.479 3.958 . 0 0 "[ . 1 . 2]" 1
717 1 35 ASP H 1 68 VAL MG1 4.770 . 5.490 4.199 3.611 4.815 . 0 0 "[ . 1 . 2]" 1
718 1 35 ASP H 1 68 VAL MG2 4.830 . 5.550 4.469 3.688 5.146 . 0 0 "[ . 1 . 2]" 1
719 1 35 ASP HA 1 36 ILE H 2.890 . 3.320 2.303 2.132 2.500 . 0 0 "[ . 1 . 2]" 1
720 1 35 ASP HA 1 36 ILE HB 4.990 . 5.740 4.736 4.594 4.989 . 0 0 "[ . 1 . 2]" 1
721 1 35 ASP HB2 1 68 VAL HB 4.430 . 5.090 3.527 3.024 4.165 . 0 0 "[ . 1 . 2]" 1
722 1 35 ASP HB2 1 68 VAL MG1 5.500 . 6.330 4.494 3.854 5.137 . 0 0 "[ . 1 . 2]" 1
723 1 35 ASP HB2 1 68 VAL MG2 5.310 . 6.110 4.019 3.423 4.477 . 0 0 "[ . 1 . 2]" 1
724 1 35 ASP HB3 1 36 ILE H 3.600 . 4.140 2.667 2.152 3.304 . 0 0 "[ . 1 . 2]" 1
725 1 36 ILE H 1 36 ILE HB 2.920 . 3.360 2.515 2.469 2.568 . 0 0 "[ . 1 . 2]" 1
726 1 36 ILE H 1 36 ILE MD 4.140 . 4.760 3.433 3.215 3.604 . 0 0 "[ . 1 . 2]" 1
727 1 36 ILE H 1 36 ILE HG12 3.950 . 4.540 2.423 2.106 2.669 . 0 0 "[ . 1 . 2]" 1
728 1 36 ILE H 1 36 ILE HG13 3.950 . 4.540 3.820 3.582 4.012 . 0 0 "[ . 1 . 2]" 1
729 1 36 ILE H 1 36 ILE MG 3.910 . 4.500 3.802 3.779 3.835 . 0 0 "[ . 1 . 2]" 1
730 1 36 ILE HA 1 36 ILE MD 3.890 . 4.470 2.034 1.985 2.098 . 0 0 "[ . 1 . 2]" 1
731 1 36 ILE HA 1 36 ILE QG 3.730 . 4.290 2.954 2.896 3.006 . 0 0 "[ . 1 . 2]" 1
732 1 36 ILE HA 1 36 ILE MG 3.240 . 3.730 2.421 2.389 2.457 . 0 0 "[ . 1 . 2]" 1
733 1 36 ILE HA 1 37 VAL H 3.020 . 3.470 2.207 2.156 2.261 . 0 0 "[ . 1 . 2]" 1
734 1 36 ILE HA 1 37 VAL HA 4.380 . 5.040 4.381 4.356 4.436 . 0 0 "[ . 1 . 2]" 1
735 1 36 ILE HA 1 37 VAL QG 4.180 . 4.810 3.503 3.440 3.592 . 0 0 "[ . 1 . 2]" 1
736 1 36 ILE HA 1 67 GLU HA 3.460 . 3.980 2.417 2.254 2.694 . 0 0 "[ . 1 . 2]" 1
737 1 36 ILE HA 1 68 VAL H 4.460 . 5.130 3.492 2.964 3.945 . 0 0 "[ . 1 . 2]" 1
738 1 36 ILE HB 1 36 ILE MD 3.490 . 4.010 3.244 3.239 3.247 . 0 0 "[ . 1 . 2]" 1
739 1 36 ILE HB 1 37 VAL H 4.080 . 4.690 4.052 3.890 4.165 . 0 0 "[ . 1 . 2]" 1
740 1 36 ILE MD 1 36 ILE MG 3.040 . 3.500 2.015 1.980 2.043 . 0 0 "[ . 1 . 2]" 1
741 1 36 ILE MD 1 37 VAL H 4.060 . 4.670 3.622 3.508 3.702 . 0 0 "[ . 1 . 2]" 1
742 1 36 ILE MD 1 65 ASN HB2 4.050 . 4.660 3.897 3.006 4.532 . 0 0 "[ . 1 . 2]" 1
743 1 36 ILE MD 1 65 ASN HB3 5.020 . 5.770 4.850 4.198 5.307 . 0 0 "[ . 1 . 2]" 1
744 1 36 ILE MD 1 65 ASN HD21 4.390 . 5.050 3.542 1.783 5.056 0.017 18 0 "[ . 1 . 2]" 1
745 1 36 ILE MD 1 65 ASN HD22 4.390 . 5.050 3.207 2.063 4.290 . 0 0 "[ . 1 . 2]" 1
746 1 36 ILE MD 1 66 PHE H 5.420 . 6.230 4.526 3.974 5.183 . 0 0 "[ . 1 . 2]" 1
747 1 36 ILE MD 1 67 GLU HA 4.800 . 5.520 2.735 2.337 3.646 . 0 0 "[ . 1 . 2]" 1
748 1 36 ILE MD 1 67 GLU QB 3.800 . 4.370 2.535 2.088 3.731 . 0 0 "[ . 1 . 2]" 1
749 1 36 ILE MD 1 67 GLU QG 3.640 . 4.190 2.203 1.778 2.611 0.022 6 0 "[ . 1 . 2]" 1
750 1 36 ILE QG 1 37 VAL H 4.750 . 5.460 4.597 4.482 4.676 . 0 0 "[ . 1 . 2]" 1
751 1 36 ILE QG 1 65 ASN HB2 5.340 . 6.140 5.040 4.032 5.823 . 0 0 "[ . 1 . 2]" 1
752 1 36 ILE HG12 1 36 ILE MG 3.380 . 3.890 3.215 3.210 3.220 . 0 0 "[ . 1 . 2]" 1
753 1 36 ILE HG12 1 37 VAL H 5.400 . 6.210 5.068 4.983 5.146 . 0 0 "[ . 1 . 2]" 1
754 1 36 ILE HG13 1 36 ILE MG 3.380 . 3.890 2.361 2.340 2.382 . 0 0 "[ . 1 . 2]" 1
755 1 36 ILE HG13 1 37 VAL H 5.400 . 6.210 5.265 5.083 5.376 . 0 0 "[ . 1 . 2]" 1
756 1 36 ILE MG 1 37 VAL H 3.380 . 3.890 2.452 2.199 2.637 . 0 0 "[ . 1 . 2]" 1
757 1 36 ILE MG 1 65 ASN HB2 3.740 . 4.300 2.639 2.034 3.356 . 0 0 "[ . 1 . 2]" 1
758 1 36 ILE MG 1 65 ASN HB3 4.020 . 4.620 3.659 3.160 4.428 . 0 0 "[ . 1 . 2]" 1
759 1 36 ILE MG 1 65 ASN HD21 4.450 . 5.120 3.155 1.824 4.759 . 0 0 "[ . 1 . 2]" 1
760 1 36 ILE MG 1 65 ASN QD 3.840 . 4.420 2.947 1.807 4.237 . 0 0 "[ . 1 . 2]" 1
761 1 36 ILE MG 1 65 ASN HD22 4.450 . 5.120 3.741 2.912 4.753 . 0 0 "[ . 1 . 2]" 1
762 1 36 ILE MG 1 66 PHE H 4.310 . 4.960 3.240 2.853 3.882 . 0 0 "[ . 1 . 2]" 1
763 1 36 ILE MG 1 67 GLU HA 4.280 . 4.920 3.664 3.215 4.137 . 0 0 "[ . 1 . 2]" 1
764 1 37 VAL H 1 37 VAL HB 3.380 . 3.890 2.534 2.472 2.595 . 0 0 "[ . 1 . 2]" 1
765 1 37 VAL H 1 37 VAL QG . . 3.660 2.087 1.995 2.237 . 0 0 "[ . 1 . 2]" 1
766 1 37 VAL H 1 38 SER H 4.700 . 5.400 4.618 4.516 4.667 . 0 0 "[ . 1 . 2]" 1
767 1 37 VAL H 1 66 PHE H 4.600 . 5.290 3.808 3.513 4.228 . 0 0 "[ . 1 . 2]" 1
768 1 37 VAL H 1 66 PHE HB2 4.370 . 5.030 3.728 3.343 4.167 . 0 0 "[ . 1 . 2]" 1
769 1 37 VAL H 1 66 PHE HB3 4.500 . 5.180 4.406 4.149 4.696 . 0 0 "[ . 1 . 2]" 1
770 1 37 VAL H 1 67 GLU HA 3.730 . 4.290 2.969 2.702 3.380 . 0 0 "[ . 1 . 2]" 1
771 1 37 VAL H 1 68 VAL H 5.020 . 5.770 4.174 3.568 4.689 . 0 0 "[ . 1 . 2]" 1
772 1 37 VAL HA 1 38 SER H 3.060 . 3.520 2.238 2.147 2.357 . 0 0 "[ . 1 . 2]" 1
773 1 37 VAL HA 1 67 GLU HA 5.500 . 6.330 5.348 4.869 5.700 . 0 0 "[ . 1 . 2]" 1
774 1 37 VAL HB 1 38 SER H 3.920 . 4.510 4.021 3.851 4.247 . 0 0 "[ . 1 . 2]" 1
775 1 37 VAL HB 1 41 ASP HB2 5.460 . 6.280 4.565 4.333 4.875 . 0 0 "[ . 1 . 2]" 1
776 1 37 VAL HB 1 41 ASP QB 4.600 . 5.290 4.338 4.177 4.645 . 0 0 "[ . 1 . 2]" 1
777 1 37 VAL HB 1 41 ASP HB3 5.460 . 6.280 5.448 5.063 6.360 0.080 14 0 "[ . 1 . 2]" 1
778 1 37 VAL HB 1 42 GLY H 4.680 . 5.380 4.551 4.344 4.780 . 0 0 "[ . 1 . 2]" 1
779 1 37 VAL HB 1 45 LEU QD 4.960 . 5.700 3.344 3.009 3.696 . 0 0 "[ . 1 . 2]" 1
780 1 37 VAL HB 1 66 PHE HB2 4.130 . 4.750 2.091 1.792 2.344 0.008 13 0 "[ . 1 . 2]" 1
781 1 37 VAL HB 1 66 PHE HB3 4.260 . 4.900 3.372 3.056 3.741 . 0 0 "[ . 1 . 2]" 1
782 1 37 VAL QG 1 38 SER H 3.330 . 3.830 2.389 2.133 2.766 . 0 0 "[ . 1 . 2]" 1
783 1 37 VAL QG 1 41 ASP H 3.800 . 4.370 3.843 3.586 3.988 . 0 0 "[ . 1 . 2]" 1
784 1 37 VAL QG 1 41 ASP HA 4.250 . 4.890 4.003 3.856 4.274 . 0 0 "[ . 1 . 2]" 1
785 1 37 VAL QG 1 41 ASP HB2 3.760 . 4.320 1.983 1.865 2.234 . 0 0 "[ . 1 . 2]" 1
786 1 37 VAL QG 1 41 ASP QB 3.250 . 3.740 1.916 1.837 2.173 . 0 0 "[ . 1 . 2]" 1
787 1 37 VAL QG 1 41 ASP HB3 3.760 . 4.320 2.593 2.245 3.271 . 0 0 "[ . 1 . 2]" 1
788 1 37 VAL QG 1 42 GLY H 3.520 . 4.050 2.552 2.360 3.129 . 0 0 "[ . 1 . 2]" 1
789 1 37 VAL QG 1 42 GLY QA 5.170 . 5.240 2.560 2.280 3.222 . 0 0 "[ . 1 . 2]" 1
790 1 37 VAL QG 1 43 ALA H 5.170 . 5.950 4.715 4.492 5.349 . 0 0 "[ . 1 . 2]" 1
791 1 37 VAL QG 1 45 LEU QD 3.470 . 3.990 2.013 1.748 2.226 0.052 20 0 "[ . 1 . 2]" 1
792 1 37 VAL QG 1 66 PHE H 4.490 . 5.160 3.871 3.624 4.133 . 0 0 "[ . 1 . 2]" 1
793 1 37 VAL QG 1 66 PHE HA 4.470 . 5.140 4.128 3.964 4.299 . 0 0 "[ . 1 . 2]" 1
794 1 37 VAL QG 1 66 PHE HB2 3.700 . 4.260 2.478 2.245 2.755 . 0 0 "[ . 1 . 2]" 1
795 1 37 VAL QG 1 66 PHE HB3 3.920 . 4.510 2.532 2.276 2.747 . 0 0 "[ . 1 . 2]" 1
796 1 37 VAL QG 1 66 PHE QD 4.180 . 4.810 3.587 3.378 3.790 . 0 0 "[ . 1 . 2]" 1
797 1 37 VAL QG 1 67 GLU H 3.990 . 4.590 3.817 3.352 4.255 . 0 0 "[ . 1 . 2]" 1
798 1 37 VAL QG 1 67 GLU HA 3.860 . 4.440 2.995 2.374 3.471 . 0 0 "[ . 1 . 2]" 1
799 1 37 VAL QG 1 68 VAL H 4.440 . 5.110 3.397 2.718 3.772 . 0 0 "[ . 1 . 2]" 1
800 1 37 VAL QG 1 78 PHE QB 5.340 . 6.140 3.805 3.453 4.124 . 0 0 "[ . 1 . 2]" 1
801 1 37 VAL QG 1 78 PHE HD1 3.610 . 4.150 2.272 2.021 2.582 . 0 0 "[ . 1 . 2]" 1
802 1 37 VAL QG 1 78 PHE HE1 3.980 . 4.580 2.536 2.289 3.113 . 0 0 "[ . 1 . 2]" 1
803 1 38 SER H 1 38 SER HB2 3.720 . 4.280 2.880 2.482 3.645 . 0 0 "[ . 1 . 2]" 1
804 1 38 SER H 1 38 SER HB3 3.720 . 4.280 2.935 2.392 3.624 . 0 0 "[ . 1 . 2]" 1
805 1 38 SER H 1 41 ASP H 4.780 . 5.500 4.539 4.067 4.854 . 0 0 "[ . 1 . 2]" 1
806 1 38 SER H 1 41 ASP HB2 4.350 . 5.000 3.098 2.555 3.856 . 0 0 "[ . 1 . 2]" 1
807 1 38 SER H 1 41 ASP QB 3.750 . 4.310 3.045 2.523 3.736 . 0 0 "[ . 1 . 2]" 1
808 1 38 SER H 1 41 ASP HB3 4.350 . 5.000 4.499 3.889 5.007 0.007 14 0 "[ . 1 . 2]" 1
809 1 38 SER H 1 42 GLY H 4.880 . 5.610 4.375 4.014 4.990 . 0 0 "[ . 1 . 2]" 1
810 1 38 SER HA 1 39 THR H 3.070 . 3.530 2.464 2.257 2.635 . 0 0 "[ . 1 . 2]" 1
811 1 38 SER HA 1 39 THR HA 4.410 . 5.070 4.299 4.222 4.368 . 0 0 "[ . 1 . 2]" 1
812 1 38 SER HA 1 40 VAL H 5.070 . 5.830 4.705 4.123 5.332 . 0 0 "[ . 1 . 2]" 1
813 1 38 SER QB 1 39 THR H 3.840 . 4.420 2.579 1.923 3.445 . 0 0 "[ . 1 . 2]" 1
814 1 38 SER QB 1 39 THR MG 5.210 . 5.990 5.300 4.889 5.745 . 0 0 "[ . 1 . 2]" 1
815 1 38 SER QB 1 40 VAL H 3.560 . 4.090 3.300 2.774 3.919 . 0 0 "[ . 1 . 2]" 1
816 1 38 SER QB 1 40 VAL MG2 4.300 . 4.950 4.096 3.528 4.773 . 0 0 "[ . 1 . 2]" 1
817 1 38 SER HB2 1 40 VAL MG2 5.120 . 5.890 4.769 3.615 5.783 . 0 0 "[ . 1 . 2]" 1
818 1 38 SER HB3 1 40 VAL MG2 5.120 . 5.890 4.685 3.718 5.640 . 0 0 "[ . 1 . 2]" 1
819 1 39 THR H 1 39 THR HB 3.410 . 3.920 2.604 2.539 2.674 . 0 0 "[ . 1 . 2]" 1
820 1 39 THR H 1 39 THR MG 3.880 . 4.460 3.782 3.762 3.793 . 0 0 "[ . 1 . 2]" 1
821 1 39 THR H 1 40 VAL H 3.660 . 4.210 2.834 2.606 3.086 . 0 0 "[ . 1 . 2]" 1
822 1 39 THR H 1 40 VAL HB 5.020 . 5.770 5.089 4.863 5.302 . 0 0 "[ . 1 . 2]" 1
823 1 39 THR H 1 41 ASP H 5.170 . 5.950 4.554 4.274 4.880 . 0 0 "[ . 1 . 2]" 1
824 1 39 THR HA 1 39 THR MG 3.240 . 3.730 2.394 2.344 2.436 . 0 0 "[ . 1 . 2]" 1
825 1 39 THR HA 1 42 GLY H 4.370 . 5.030 3.747 3.286 4.014 . 0 0 "[ . 1 . 2]" 1
826 1 39 THR HB 1 40 VAL H 3.260 . 3.750 2.504 2.072 2.942 . 0 0 "[ . 1 . 2]" 1
827 1 39 THR HB 1 40 VAL HA 4.230 . 4.860 4.252 4.128 4.406 . 0 0 "[ . 1 . 2]" 1
828 1 39 THR HB 1 40 VAL MG2 4.270 . 4.910 3.116 2.775 3.440 . 0 0 "[ . 1 . 2]" 1
829 1 39 THR HB 1 41 ASP H 5.460 . 6.280 5.237 4.640 5.770 . 0 0 "[ . 1 . 2]" 1
830 1 39 THR MG 1 40 VAL H 3.820 . 4.390 3.404 2.991 3.813 . 0 0 "[ . 1 . 2]" 1
831 1 39 THR MG 1 40 VAL HA 4.380 . 5.040 3.476 3.199 3.802 . 0 0 "[ . 1 . 2]" 1
832 1 39 THR MG 1 42 GLY H 4.900 . 5.640 4.937 4.543 5.270 . 0 0 "[ . 1 . 2]" 1
833 1 39 THR MG 1 42 GLY QA 5.030 . 5.780 4.820 4.170 5.321 . 0 0 "[ . 1 . 2]" 1
834 1 39 THR MG 1 43 ALA H 4.450 . 5.120 4.120 3.874 4.571 . 0 0 "[ . 1 . 2]" 1
835 1 40 VAL H 1 40 VAL HB 2.900 . 3.340 2.583 2.529 2.617 . 0 0 "[ . 1 . 2]" 1
836 1 40 VAL H 1 40 VAL MG1 3.930 . 4.520 3.790 3.783 3.798 . 0 0 "[ . 1 . 2]" 1
837 1 40 VAL H 1 40 VAL MG2 2.850 . 3.280 2.030 1.938 2.182 . 0 0 "[ . 1 . 2]" 1
838 1 40 VAL H 1 41 ASP H 3.240 . 3.730 2.842 2.670 2.977 . 0 0 "[ . 1 . 2]" 1
839 1 40 VAL H 1 42 GLY H 4.430 . 5.090 4.017 3.737 4.285 . 0 0 "[ . 1 . 2]" 1
840 1 40 VAL H 1 43 ALA MB 5.110 . 5.880 4.858 4.590 5.370 . 0 0 "[ . 1 . 2]" 1
841 1 40 VAL HA 1 40 VAL MG1 3.300 . 3.800 2.406 2.384 2.439 . 0 0 "[ . 1 . 2]" 1
842 1 40 VAL HA 1 40 VAL MG2 3.060 . 3.520 2.413 2.378 2.448 . 0 0 "[ . 1 . 2]" 1
843 1 40 VAL HA 1 43 ALA H 4.050 . 4.660 3.595 3.405 3.865 . 0 0 "[ . 1 . 2]" 1
844 1 40 VAL HA 1 43 ALA MB 3.260 . 3.750 2.913 2.585 3.539 . 0 0 "[ . 1 . 2]" 1
845 1 40 VAL HB 1 41 ASP H 3.360 . 3.860 2.300 2.077 2.476 . 0 0 "[ . 1 . 2]" 1
846 1 40 VAL HB 1 41 ASP QB 5.340 . 6.140 4.542 4.370 4.687 . 0 0 "[ . 1 . 2]" 1
847 1 40 VAL MG1 1 41 ASP H 3.230 . 3.710 3.200 2.883 3.454 . 0 0 "[ . 1 . 2]" 1
848 1 40 VAL MG1 1 42 GLY H 4.950 . 5.690 4.946 4.699 5.137 . 0 0 "[ . 1 . 2]" 1
849 1 40 VAL MG1 1 43 ALA H 5.200 . 5.980 4.805 4.624 4.963 . 0 0 "[ . 1 . 2]" 1
850 1 40 VAL MG1 1 43 ALA MB 4.130 . 4.750 3.764 3.459 4.204 . 0 0 "[ . 1 . 2]" 1
851 1 40 VAL MG1 1 44 PHE H 4.480 . 5.150 4.363 3.912 4.910 . 0 0 "[ . 1 . 2]" 1
852 1 41 ASP H 1 41 ASP HB2 3.680 . 4.230 2.643 2.514 3.342 . 0 0 "[ . 1 . 2]" 1
853 1 41 ASP H 1 41 ASP QB 3.060 . 3.520 2.568 2.468 2.977 . 0 0 "[ . 1 . 2]" 1
854 1 41 ASP H 1 41 ASP HB3 3.680 . 4.230 3.570 3.341 3.604 . 0 0 "[ . 1 . 2]" 1
855 1 41 ASP H 1 42 GLY H 3.180 . 3.660 2.758 2.535 2.877 . 0 0 "[ . 1 . 2]" 1
856 1 41 ASP H 1 42 GLY QA 5.240 . 6.030 4.611 4.428 4.703 . 0 0 "[ . 1 . 2]" 1
857 1 41 ASP H 1 43 ALA H 4.750 . 5.460 4.380 4.237 4.595 . 0 0 "[ . 1 . 2]" 1
858 1 41 ASP H 1 44 PHE H 5.210 . 5.990 4.940 4.741 5.134 . 0 0 "[ . 1 . 2]" 1
859 1 41 ASP HA 1 43 ALA H 4.810 . 5.530 4.567 4.326 4.820 . 0 0 "[ . 1 . 2]" 1
860 1 41 ASP HA 1 44 PHE H 3.810 . 4.380 3.543 3.302 3.857 . 0 0 "[ . 1 . 2]" 1
861 1 41 ASP HA 1 44 PHE HB2 4.150 . 4.770 3.363 2.942 3.738 . 0 0 "[ . 1 . 2]" 1
862 1 41 ASP HA 1 44 PHE HB3 4.800 . 5.520 2.942 2.488 3.262 . 0 0 "[ . 1 . 2]" 1
863 1 41 ASP QB 1 42 GLY H 3.560 . 4.090 2.601 2.419 3.166 . 0 0 "[ . 1 . 2]" 1
864 1 41 ASP HB2 1 42 GLY H 4.140 . 4.760 2.651 2.459 3.255 . 0 0 "[ . 1 . 2]" 1
865 1 41 ASP HB3 1 42 GLY H 4.140 . 4.760 3.781 3.578 4.325 . 0 0 "[ . 1 . 2]" 1
866 1 42 GLY H 1 43 ALA H 3.250 . 3.740 2.790 2.702 2.917 . 0 0 "[ . 1 . 2]" 1
867 1 42 GLY H 1 43 ALA MB 4.510 . 5.190 4.418 4.332 4.529 . 0 0 "[ . 1 . 2]" 1
868 1 42 GLY H 1 44 PHE H 4.520 . 5.200 4.179 4.042 4.290 . 0 0 "[ . 1 . 2]" 1
869 1 42 GLY H 1 45 LEU QD 4.770 . 5.490 4.251 3.944 4.454 . 0 0 "[ . 1 . 2]" 1
870 1 42 GLY H 1 66 PHE QD 4.800 . 5.520 5.147 4.773 5.472 . 0 0 "[ . 1 . 2]" 1
871 1 42 GLY QA 1 45 LEU H 4.960 . 5.380 3.260 3.149 3.513 . 0 0 "[ . 1 . 2]" 1
872 1 42 GLY QA 1 45 LEU HB2 4.610 . 4.950 2.659 2.409 2.973 . 0 0 "[ . 1 . 2]" 1
873 1 42 GLY QA 1 45 LEU HB3 4.840 . 5.570 4.181 3.930 4.508 . 0 0 "[ . 1 . 2]" 1
874 1 42 GLY QA 1 45 LEU QD 4.560 . 4.960 2.258 2.046 2.538 . 0 0 "[ . 1 . 2]" 1
875 1 42 GLY QA 1 46 VAL H 4.580 . 5.270 3.987 3.857 4.228 . 0 0 "[ . 1 . 2]" 1
876 1 42 GLY QA 1 63 VAL MG1 5.360 . 6.160 4.818 4.275 5.137 . 0 0 "[ . 1 . 2]" 1
877 1 42 GLY QA 1 66 PHE QD 4.080 . 4.520 2.765 2.494 2.972 . 0 0 "[ . 1 . 2]" 1
878 1 43 ALA H 1 43 ALA MB 2.570 . 2.960 2.238 2.231 2.244 . 0 0 "[ . 1 . 2]" 1
879 1 43 ALA H 1 44 PHE H 3.130 . 3.600 2.759 2.694 2.811 . 0 0 "[ . 1 . 2]" 1
880 1 43 ALA H 1 44 PHE HA 5.500 . 6.330 5.375 5.313 5.422 . 0 0 "[ . 1 . 2]" 1
881 1 43 ALA H 1 44 PHE HB2 5.420 . 6.230 5.118 4.947 5.261 . 0 0 "[ . 1 . 2]" 1
882 1 43 ALA H 1 45 LEU H 4.390 . 5.050 4.289 4.161 4.417 . 0 0 "[ . 1 . 2]" 1
883 1 43 ALA H 1 66 PHE QD 5.500 . 6.330 5.549 5.179 5.947 . 0 0 "[ . 1 . 2]" 1
884 1 43 ALA H 1 66 PHE QE 5.500 . 6.330 5.473 5.027 6.042 . 0 0 "[ . 1 . 2]" 1
885 1 43 ALA HA 1 45 LEU H 4.630 . 5.320 4.512 4.283 4.669 . 0 0 "[ . 1 . 2]" 1
886 1 43 ALA HA 1 46 VAL H 3.790 . 4.360 3.362 3.158 3.511 . 0 0 "[ . 1 . 2]" 1
887 1 43 ALA HA 1 46 VAL HB 3.730 . 4.290 2.801 2.508 3.016 . 0 0 "[ . 1 . 2]" 1
888 1 43 ALA HA 1 46 VAL QG 4.070 . 4.350 2.490 2.335 2.689 . 0 0 "[ . 1 . 2]" 1
889 1 43 ALA MB 1 44 PHE H 3.070 . 3.530 2.561 2.431 2.646 . 0 0 "[ . 1 . 2]" 1
890 1 43 ALA MB 1 46 VAL H 4.790 . 5.510 4.563 4.399 4.691 . 0 0 "[ . 1 . 2]" 1
891 1 43 ALA MB 1 46 VAL HB 4.540 . 5.220 4.018 3.768 4.259 . 0 0 "[ . 1 . 2]" 1
892 1 44 PHE H 1 44 PHE HB2 3.150 . 3.620 2.504 2.421 2.574 . 0 0 "[ . 1 . 2]" 1
893 1 44 PHE H 1 44 PHE HB3 3.110 . 3.580 2.522 2.455 2.577 . 0 0 "[ . 1 . 2]" 1
894 1 44 PHE H 1 44 PHE QD 5.010 . 5.760 4.192 4.170 4.202 . 0 0 "[ . 1 . 2]" 1
895 1 44 PHE H 1 45 LEU H 3.240 . 3.730 2.771 2.640 2.871 . 0 0 "[ . 1 . 2]" 1
896 1 44 PHE H 1 45 LEU QD 5.500 . 6.330 4.854 4.739 4.982 . 0 0 "[ . 1 . 2]" 1
897 1 44 PHE H 1 46 VAL H 4.520 . 5.200 4.137 4.053 4.322 . 0 0 "[ . 1 . 2]" 1
898 1 44 PHE HA 1 44 PHE QD 3.680 . 4.230 2.971 2.826 3.062 . 0 0 "[ . 1 . 2]" 1
899 1 44 PHE HA 1 46 VAL H 4.690 . 5.390 4.454 4.355 4.572 . 0 0 "[ . 1 . 2]" 1
900 1 44 PHE HA 1 47 GLU H 3.910 . 4.500 3.721 3.585 3.825 . 0 0 "[ . 1 . 2]" 1
901 1 44 PHE HA 1 47 GLU HB2 4.150 . 4.770 3.223 2.982 3.523 . 0 0 "[ . 1 . 2]" 1
902 1 44 PHE HB2 1 45 LEU H 4.000 . 4.600 3.789 3.706 3.878 . 0 0 "[ . 1 . 2]" 1
903 1 44 PHE HB3 1 45 LEU H 3.540 . 4.070 2.433 2.329 2.595 . 0 0 "[ . 1 . 2]" 1
904 1 44 PHE HB3 1 45 LEU QD 5.390 . 6.200 3.877 3.758 3.980 . 0 0 "[ . 1 . 2]" 1
905 1 44 PHE QD 1 45 LEU H 3.850 . 4.430 3.214 3.031 3.474 . 0 0 "[ . 1 . 2]" 1
906 1 44 PHE QD 1 45 LEU HA 3.660 . 4.210 3.136 2.946 3.450 . 0 0 "[ . 1 . 2]" 1
907 1 44 PHE QD 1 45 LEU QD 3.920 . 4.510 2.680 2.440 2.977 . 0 0 "[ . 1 . 2]" 1
908 1 44 PHE QE 1 45 LEU HA 4.240 . 4.880 4.550 4.274 4.822 . 0 0 "[ . 1 . 2]" 1
909 1 44 PHE QE 1 45 LEU QD 5.500 . 6.330 3.623 3.087 3.997 . 0 0 "[ . 1 . 2]" 1
910 1 44 PHE QE 1 48 ALA MB 3.710 . 4.270 3.421 3.169 3.675 . 0 0 "[ . 1 . 2]" 1
911 1 44 PHE HZ 1 48 ALA MB 4.350 . 5.000 4.471 4.137 4.883 . 0 0 "[ . 1 . 2]" 1
912 1 45 LEU H 1 45 LEU HB2 3.490 . 4.010 2.449 2.390 2.507 . 0 0 "[ . 1 . 2]" 1
913 1 45 LEU H 1 45 LEU HB3 3.720 . 4.280 3.583 3.575 3.589 . 0 0 "[ . 1 . 2]" 1
914 1 45 LEU H 1 45 LEU QD 4.190 . 4.380 3.100 3.032 3.164 . 0 0 "[ . 1 . 2]" 1
915 1 45 LEU H 1 45 LEU HG 3.280 . 3.770 2.294 2.170 2.413 . 0 0 "[ . 1 . 2]" 1
916 1 45 LEU H 1 46 VAL H 3.390 . 3.900 2.757 2.663 2.811 . 0 0 "[ . 1 . 2]" 1
917 1 45 LEU H 1 66 PHE QE 4.760 . 5.470 5.021 4.779 5.215 . 0 0 "[ . 1 . 2]" 1
918 1 45 LEU HA 1 45 LEU QD . . 3.610 2.026 1.991 2.056 . 0 0 "[ . 1 . 2]" 1
919 1 45 LEU HA 1 45 LEU HG 3.230 . 3.710 3.002 2.932 3.052 . 0 0 "[ . 1 . 2]" 1
920 1 45 LEU HA 1 48 ALA MB 3.340 . 3.840 2.302 2.089 2.467 . 0 0 "[ . 1 . 2]" 1
921 1 45 LEU HA 1 90 PHE HZ 4.480 . 5.150 3.784 3.244 4.373 . 0 0 "[ . 1 . 2]" 1
922 1 45 LEU HB2 1 46 VAL H 3.130 . 3.600 2.696 2.579 2.798 . 0 0 "[ . 1 . 2]" 1
923 1 45 LEU HB2 1 66 PHE QE 4.520 . 5.200 3.295 3.094 3.538 . 0 0 "[ . 1 . 2]" 1
924 1 45 LEU HB2 1 66 PHE HZ 4.190 . 4.820 3.628 3.298 4.073 . 0 0 "[ . 1 . 2]" 1
925 1 45 LEU HB3 1 46 VAL H 3.730 . 4.290 3.645 3.575 3.740 . 0 0 "[ . 1 . 2]" 1
926 1 45 LEU HB3 1 48 ALA MB 4.380 . 5.040 4.047 3.798 4.217 . 0 0 "[ . 1 . 2]" 1
927 1 45 LEU QD 1 46 VAL H 4.470 . 5.140 4.139 4.065 4.198 . 0 0 "[ . 1 . 2]" 1
928 1 45 LEU QD 1 66 PHE HB2 4.680 . 5.380 2.770 2.544 2.977 . 0 0 "[ . 1 . 2]" 1
929 1 45 LEU QD 1 66 PHE HB3 4.560 . 5.240 2.725 2.512 2.910 . 0 0 "[ . 1 . 2]" 1
930 1 45 LEU QD 1 66 PHE QD 4.110 . 4.730 2.694 2.578 2.824 . 0 0 "[ . 1 . 2]" 1
931 1 45 LEU QD 1 66 PHE QE 3.800 . 4.370 3.389 3.243 3.601 . 0 0 "[ . 1 . 2]" 1
932 1 45 LEU QD 1 78 PHE HD1 5.440 . 6.260 2.578 2.290 2.789 . 0 0 "[ . 1 . 2]" 1
933 1 45 LEU QD 1 78 PHE HD2 5.260 . 6.050 3.243 2.918 3.558 . 0 0 "[ . 1 . 2]" 1
934 1 45 LEU QD 1 78 PHE HZ 4.170 . 4.800 3.407 3.022 3.689 . 0 0 "[ . 1 . 2]" 1
935 1 45 LEU QD 1 90 PHE HD1 5.050 . 5.810 5.106 4.780 5.396 . 0 0 "[ . 1 . 2]" 1
936 1 45 LEU QD 1 90 PHE HE1 3.930 . 4.520 3.303 2.932 3.613 . 0 0 "[ . 1 . 2]" 1
937 1 45 LEU QD 1 90 PHE HZ 3.550 . 4.080 2.032 1.816 2.300 . 0 0 "[ . 1 . 2]" 1
938 1 45 LEU HG 1 46 VAL H 5.320 . 6.120 4.470 4.352 4.556 . 0 0 "[ . 1 . 2]" 1
939 1 45 LEU HG 1 90 PHE HZ 5.180 . 5.960 4.838 4.372 5.336 . 0 0 "[ . 1 . 2]" 1
940 1 46 VAL H 1 46 VAL HB 2.960 . 3.400 2.587 2.552 2.633 . 0 0 "[ . 1 . 2]" 1
941 1 46 VAL H 1 46 VAL QG . . 3.600 2.049 2.007 2.102 . 0 0 "[ . 1 . 2]" 1
942 1 46 VAL H 1 47 GLU H 3.210 . 3.690 2.856 2.755 2.933 . 0 0 "[ . 1 . 2]" 1
943 1 46 VAL H 1 47 GLU HB2 5.050 . 5.810 4.969 4.810 5.183 . 0 0 "[ . 1 . 2]" 1
944 1 46 VAL H 1 48 ALA H 4.620 . 5.310 4.155 4.032 4.321 . 0 0 "[ . 1 . 2]" 1
945 1 46 VAL H 1 48 ALA MB 5.500 . 6.330 4.666 4.535 4.764 . 0 0 "[ . 1 . 2]" 1
946 1 46 VAL H 1 66 PHE QE 3.520 . 4.050 3.574 3.112 3.854 . 0 0 "[ . 1 . 2]" 1
947 1 46 VAL H 1 66 PHE HZ 4.020 . 4.620 3.795 3.412 4.189 . 0 0 "[ . 1 . 2]" 1
948 1 46 VAL HA 1 46 VAL QG 3.110 . 3.580 2.148 2.143 2.155 . 0 0 "[ . 1 . 2]" 1
949 1 46 VAL HA 1 49 LEU H 3.830 . 4.400 3.530 3.376 3.709 . 0 0 "[ . 1 . 2]" 1
950 1 46 VAL HA 1 49 LEU HB3 3.570 . 4.110 2.775 2.596 2.942 . 0 0 "[ . 1 . 2]" 1
951 1 46 VAL HA 1 49 LEU MD2 3.980 . 4.580 3.374 3.087 3.612 . 0 0 "[ . 1 . 2]" 1
952 1 46 VAL HA 1 63 VAL MG2 4.130 . 4.750 3.752 2.859 4.191 . 0 0 "[ . 1 . 2]" 1
953 1 46 VAL HA 1 66 PHE QE 4.090 . 4.700 3.689 2.929 3.983 . 0 0 "[ . 1 . 2]" 1
954 1 46 VAL HA 1 66 PHE HZ 3.390 . 3.900 2.713 2.406 3.051 . 0 0 "[ . 1 . 2]" 1
955 1 46 VAL HB 1 47 GLU H 3.350 . 3.850 2.450 2.375 2.564 . 0 0 "[ . 1 . 2]" 1
956 1 46 VAL HB 1 63 VAL MG1 4.770 . 5.490 5.213 4.604 5.554 0.064 4 0 "[ . 1 . 2]" 1
957 1 46 VAL HB 1 66 PHE QE 4.470 . 5.140 4.591 4.274 4.944 . 0 0 "[ . 1 . 2]" 1
958 1 46 VAL HB 1 66 PHE HZ 4.670 . 5.370 5.008 4.654 5.408 0.038 10 0 "[ . 1 . 2]" 1
959 1 46 VAL QG 1 47 GLU H 4.020 . 4.090 3.094 3.001 3.201 . 0 0 "[ . 1 . 2]" 1
960 1 46 VAL QG 1 47 GLU QG 4.260 . 4.900 3.622 3.419 3.798 . 0 0 "[ . 1 . 2]" 1
961 1 46 VAL QG 1 48 ALA H 5.070 . 5.830 4.653 4.551 4.815 . 0 0 "[ . 1 . 2]" 1
962 1 46 VAL QG 1 49 LEU H 4.840 . 5.570 4.360 4.232 4.527 . 0 0 "[ . 1 . 2]" 1
963 1 46 VAL QG 1 50 LYS HE2 3.890 . 4.470 2.921 1.784 4.406 0.016 11 0 "[ . 1 . 2]" 1
964 1 46 VAL QG 1 50 LYS QE 3.320 . 3.820 2.323 1.755 3.813 0.045 3 0 "[ . 1 . 2]" 1
965 1 46 VAL QG 1 50 LYS HE3 3.890 . 4.470 2.917 1.766 4.200 0.034 3 0 "[ . 1 . 2]" 1
966 1 46 VAL QG 1 63 VAL H 5.320 . 6.120 4.573 3.997 5.150 . 0 0 "[ . 1 . 2]" 1
967 1 46 VAL QG 1 63 VAL HB 3.400 . 3.910 3.138 2.601 3.680 . 0 0 "[ . 1 . 2]" 1
968 1 46 VAL QG 1 63 VAL MG1 3.310 . 3.810 2.448 1.810 2.770 . 0 0 "[ . 1 . 2]" 1
969 1 46 VAL QG 1 63 VAL MG2 3.110 . 3.580 2.445 1.936 2.828 . 0 0 "[ . 1 . 2]" 1
970 1 46 VAL QG 1 66 PHE QE 3.070 . 3.530 2.034 1.791 2.380 0.009 16 0 "[ . 1 . 2]" 1
971 1 46 VAL QG 1 66 PHE HZ 3.370 . 3.880 2.678 2.236 3.224 . 0 0 "[ . 1 . 2]" 1
972 1 47 GLU H 1 47 GLU HB2 3.110 . 3.580 2.473 2.298 2.567 . 0 0 "[ . 1 . 2]" 1
973 1 47 GLU H 1 47 GLU HB3 3.980 . 4.580 3.602 3.558 3.622 . 0 0 "[ . 1 . 2]" 1
974 1 47 GLU H 1 47 GLU HG2 4.130 . 4.750 2.314 2.129 2.606 . 0 0 "[ . 1 . 2]" 1
975 1 47 GLU H 1 47 GLU QG 3.270 . 3.760 2.290 2.115 2.556 . 0 0 "[ . 1 . 2]" 1
976 1 47 GLU H 1 47 GLU HG3 4.130 . 4.750 3.696 3.586 3.809 . 0 0 "[ . 1 . 2]" 1
977 1 47 GLU H 1 48 ALA H 3.240 . 3.730 2.713 2.617 2.839 . 0 0 "[ . 1 . 2]" 1
978 1 47 GLU H 1 48 ALA MB 4.550 . 5.230 4.360 4.276 4.447 . 0 0 "[ . 1 . 2]" 1
979 1 47 GLU H 1 49 LEU H 4.200 . 4.830 4.043 3.859 4.214 . 0 0 "[ . 1 . 2]" 1
980 1 47 GLU H 1 50 LYS QD 4.990 . 5.740 4.583 3.862 5.390 . 0 0 "[ . 1 . 2]" 1
981 1 47 GLU HA 1 47 GLU QG 3.630 . 4.170 2.928 2.669 3.057 . 0 0 "[ . 1 . 2]" 1
982 1 47 GLU HA 1 50 LYS H 3.820 . 4.390 3.302 3.114 3.619 . 0 0 "[ . 1 . 2]" 1
983 1 47 GLU HA 1 50 LYS QD 3.850 . 4.430 2.582 2.131 4.246 . 0 0 "[ . 1 . 2]" 1
984 1 47 GLU HA 1 50 LYS QE 4.680 . 5.380 3.737 2.095 5.173 . 0 0 "[ . 1 . 2]" 1
985 1 47 GLU HB2 1 48 ALA H 3.480 . 4.000 2.613 2.482 2.762 . 0 0 "[ . 1 . 2]" 1
986 1 47 GLU HB3 1 48 ALA H 4.430 . 5.090 3.580 3.228 3.818 . 0 0 "[ . 1 . 2]" 1
987 1 47 GLU QG 1 48 ALA H 4.280 . 4.920 4.089 3.917 4.246 . 0 0 "[ . 1 . 2]" 1
988 1 47 GLU QG 1 50 LYS QD 4.610 . 5.300 4.113 3.513 5.329 0.029 9 0 "[ . 1 . 2]" 1
989 1 47 GLU HG2 1 48 ALA H 4.980 . 5.730 4.363 4.141 4.585 . 0 0 "[ . 1 . 2]" 1
990 1 47 GLU HG3 1 48 ALA H 4.980 . 5.730 4.949 4.824 5.105 . 0 0 "[ . 1 . 2]" 1
991 1 48 ALA H 1 48 ALA MB 2.960 . 3.400 2.243 2.232 2.253 . 0 0 "[ . 1 . 2]" 1
992 1 48 ALA H 1 49 LEU H 3.470 . 3.990 2.701 2.530 2.805 . 0 0 "[ . 1 . 2]" 1
993 1 48 ALA H 1 50 LYS H 4.830 . 5.550 4.314 4.073 4.590 . 0 0 "[ . 1 . 2]" 1
994 1 48 ALA HA 1 51 ARG QB 4.020 . 4.620 3.847 2.691 4.644 0.024 11 0 "[ . 1 . 2]" 1
995 1 48 ALA HA 1 51 ARG HD2 4.580 . 5.270 3.489 1.884 5.276 0.006 6 0 "[ . 1 . 2]" 1
996 1 48 ALA HA 1 51 ARG QD 3.910 . 4.500 3.045 1.863 4.285 . 0 0 "[ . 1 . 2]" 1
997 1 48 ALA HA 1 51 ARG HD3 4.580 . 5.270 3.867 2.489 5.286 0.016 8 0 "[ . 1 . 2]" 1
998 1 48 ALA HA 1 51 ARG QG 4.020 . 4.620 2.989 2.179 4.633 0.013 10 0 "[ . 1 . 2]" 1
999 1 48 ALA MB 1 49 LEU H 3.080 . 3.540 2.681 2.490 2.856 . 0 0 "[ . 1 . 2]" 1
1000 1 48 ALA MB 1 49 LEU HB3 4.640 . 5.340 4.652 4.532 4.774 . 0 0 "[ . 1 . 2]" 1
1001 1 48 ALA MB 1 90 PHE HE2 4.480 . 5.150 3.434 2.829 3.995 . 0 0 "[ . 1 . 2]" 1
1002 1 48 ALA MB 1 90 PHE HZ 4.070 . 4.680 3.925 3.515 4.494 . 0 0 "[ . 1 . 2]" 1
1003 1 49 LEU H 1 49 LEU HB2 3.070 . 3.530 2.610 2.448 2.703 . 0 0 "[ . 1 . 2]" 1
1004 1 49 LEU H 1 49 LEU HB3 3.230 . 3.710 2.435 2.357 2.562 . 0 0 "[ . 1 . 2]" 1
1005 1 49 LEU H 1 49 LEU MD1 4.310 . 4.960 4.167 4.044 4.222 . 0 0 "[ . 1 . 2]" 1
1006 1 49 LEU H 1 49 LEU MD2 4.250 . 4.890 4.262 4.211 4.303 . 0 0 "[ . 1 . 2]" 1
1007 1 49 LEU H 1 49 LEU HG 4.950 . 5.690 4.443 4.394 4.526 . 0 0 "[ . 1 . 2]" 1
1008 1 49 LEU H 1 50 LYS H 3.670 . 4.220 2.631 2.503 2.824 . 0 0 "[ . 1 . 2]" 1
1009 1 49 LEU H 1 51 ARG H 4.810 . 5.530 4.123 3.880 4.389 . 0 0 "[ . 1 . 2]" 1
1010 1 49 LEU H 1 59 ILE MD 5.500 . 6.330 5.656 5.177 6.154 . 0 0 "[ . 1 . 2]" 1
1011 1 49 LEU H 1 66 PHE HZ 5.500 . 6.330 5.142 4.493 5.545 . 0 0 "[ . 1 . 2]" 1
1012 1 49 LEU H 1 90 PHE HE2 5.500 . 6.330 5.236 4.143 5.732 . 0 0 "[ . 1 . 2]" 1
1013 1 49 LEU H 1 90 PHE HZ 5.270 . 6.060 5.328 4.934 5.642 . 0 0 "[ . 1 . 2]" 1
1014 1 49 LEU HA 1 49 LEU MD1 3.410 . 3.920 2.116 2.032 2.179 . 0 0 "[ . 1 . 2]" 1
1015 1 49 LEU HA 1 49 LEU MD2 4.000 . 4.600 3.898 3.870 3.924 . 0 0 "[ . 1 . 2]" 1
1016 1 49 LEU HA 1 51 ARG H 4.750 . 5.460 4.073 3.740 4.502 . 0 0 "[ . 1 . 2]" 1
1017 1 49 LEU HA 1 52 HIS H 4.160 . 4.780 4.237 3.756 4.736 . 0 0 "[ . 1 . 2]" 1
1018 1 49 LEU HA 1 52 HIS QB 4.050 . 4.660 3.770 3.259 4.184 . 0 0 "[ . 1 . 2]" 1
1019 1 49 LEU HA 1 90 PHE HE2 4.520 . 5.200 4.618 3.756 5.202 0.002 13 0 "[ . 1 . 2]" 1
1020 1 49 LEU HA 1 90 PHE HZ 4.820 . 5.540 5.519 5.242 5.589 0.049 5 0 "[ . 1 . 2]" 1
1021 1 49 LEU HB2 1 49 LEU MD1 3.480 . 4.000 2.400 2.364 2.436 . 0 0 "[ . 1 . 2]" 1
1022 1 49 LEU HB2 1 49 LEU MD2 3.480 . 4.000 2.394 2.364 2.427 . 0 0 "[ . 1 . 2]" 1
1023 1 49 LEU HB3 1 50 LYS H 4.650 . 5.350 2.504 2.264 2.722 . 0 0 "[ . 1 . 2]" 1
1024 1 49 LEU HB3 1 50 LYS HA 4.740 . 5.450 4.260 4.120 4.379 . 0 0 "[ . 1 . 2]" 1
1025 1 49 LEU HB3 1 66 PHE HZ 4.010 . 4.610 4.136 3.411 4.580 . 0 0 "[ . 1 . 2]" 1
1026 1 49 LEU MD1 1 50 LYS H 4.810 . 5.530 4.390 4.229 4.498 . 0 0 "[ . 1 . 2]" 1
1027 1 49 LEU MD1 1 51 ARG H 5.310 . 6.110 5.145 4.759 5.568 . 0 0 "[ . 1 . 2]" 1
1028 1 49 LEU MD1 1 52 HIS H 4.940 . 5.680 4.397 4.089 4.884 . 0 0 "[ . 1 . 2]" 1
1029 1 49 LEU MD1 1 52 HIS HB2 4.300 . 4.950 3.111 2.561 3.640 . 0 0 "[ . 1 . 2]" 1
1030 1 49 LEU MD1 1 52 HIS QB 3.700 . 4.260 3.035 2.502 3.547 . 0 0 "[ . 1 . 2]" 1
1031 1 49 LEU MD1 1 52 HIS HB3 4.300 . 4.950 4.230 3.513 4.900 . 0 0 "[ . 1 . 2]" 1
1032 1 49 LEU MD1 1 55 ALA HA 4.440 . 5.110 2.796 2.316 3.395 . 0 0 "[ . 1 . 2]" 1
1033 1 49 LEU MD1 1 55 ALA MB 3.900 . 4.490 3.296 2.343 4.234 . 0 0 "[ . 1 . 2]" 1
1034 1 49 LEU MD1 1 57 SER H 5.500 . 6.330 6.019 5.550 6.367 0.037 18 0 "[ . 1 . 2]" 1
1035 1 49 LEU MD1 1 58 LYS H 5.340 . 6.140 4.450 3.972 4.951 . 0 0 "[ . 1 . 2]" 1
1036 1 49 LEU MD1 1 58 LYS HB2 4.610 . 5.300 2.576 1.940 3.659 . 0 0 "[ . 1 . 2]" 1
1037 1 49 LEU MD1 1 58 LYS QB 3.950 . 4.540 2.422 1.878 3.479 . 0 0 "[ . 1 . 2]" 1
1038 1 49 LEU MD1 1 58 LYS HB3 4.610 . 5.300 3.123 2.033 4.354 . 0 0 "[ . 1 . 2]" 1
1039 1 49 LEU MD1 1 59 ILE H 5.060 . 5.820 4.805 4.245 5.495 . 0 0 "[ . 1 . 2]" 1
1040 1 49 LEU MD1 1 59 ILE MD 3.690 . 4.240 4.151 3.564 4.294 0.054 1 0 "[ . 1 . 2]" 1
1041 1 49 LEU MD1 1 66 PHE HZ 5.500 . 6.330 5.005 4.233 5.594 . 0 0 "[ . 1 . 2]" 1
1042 1 49 LEU MD1 1 80 ILE MD 3.370 . 3.880 2.267 1.997 2.923 . 0 0 "[ . 1 . 2]" 1
1043 1 49 LEU MD1 1 90 PHE HD1 4.750 . 5.460 4.074 3.357 4.712 . 0 0 "[ . 1 . 2]" 1
1044 1 49 LEU MD2 1 50 LYS H 4.890 . 5.620 4.184 3.899 4.494 . 0 0 "[ . 1 . 2]" 1
1045 1 49 LEU MD2 1 59 ILE H 4.670 . 5.370 3.927 3.371 4.634 . 0 0 "[ . 1 . 2]" 1
1046 1 49 LEU MD2 1 59 ILE HA 4.230 . 4.860 3.431 2.735 3.829 . 0 0 "[ . 1 . 2]" 1
1047 1 49 LEU MD2 1 59 ILE QG 3.460 . 3.980 2.095 1.872 2.414 . 0 0 "[ . 1 . 2]" 1
1048 1 49 LEU MD2 1 66 PHE QE 4.080 . 4.690 3.305 2.689 3.827 . 0 0 "[ . 1 . 2]" 1
1049 1 49 LEU MD2 1 66 PHE HZ 3.860 . 4.440 3.175 2.541 3.670 . 0 0 "[ . 1 . 2]" 1
1050 1 49 LEU HG 1 50 LYS H 4.160 . 4.780 3.611 3.280 3.889 . 0 0 "[ . 1 . 2]" 1
1051 1 49 LEU HG 1 50 LYS HA 3.940 . 4.530 3.590 3.273 4.015 . 0 0 "[ . 1 . 2]" 1
1052 1 49 LEU HG 1 51 ARG H 5.500 . 6.330 5.276 5.015 5.671 . 0 0 "[ . 1 . 2]" 1
1053 1 49 LEU HG 1 59 ILE HA 5.500 . 6.330 5.606 4.546 6.181 . 0 0 "[ . 1 . 2]" 1
1054 1 49 LEU HG 1 59 ILE MD 3.470 . 3.990 2.955 2.250 3.242 . 0 0 "[ . 1 . 2]" 1
1055 1 49 LEU HG 1 59 ILE QG 4.560 . 5.240 3.058 2.481 3.456 . 0 0 "[ . 1 . 2]" 1
1056 1 50 LYS H 1 50 LYS QB 2.790 . 3.210 2.421 2.308 2.509 . 0 0 "[ . 1 . 2]" 1
1057 1 50 LYS H 1 50 LYS QD 4.250 . 4.890 3.818 3.425 4.222 . 0 0 "[ . 1 . 2]" 1
1058 1 50 LYS H 1 50 LYS HG2 4.300 . 4.950 3.452 2.163 3.742 . 0 0 "[ . 1 . 2]" 1
1059 1 50 LYS H 1 50 LYS HG3 4.300 . 4.950 2.355 2.180 3.304 . 0 0 "[ . 1 . 2]" 1
1060 1 50 LYS H 1 51 ARG H 3.420 . 3.930 2.834 2.695 2.953 . 0 0 "[ . 1 . 2]" 1
1061 1 50 LYS H 1 52 HIS H 4.570 . 5.260 4.436 4.178 4.795 . 0 0 "[ . 1 . 2]" 1
1062 1 50 LYS H 1 55 ALA MB 5.080 . 5.840 4.095 3.581 4.841 . 0 0 "[ . 1 . 2]" 1
1063 1 50 LYS H 1 59 ILE MD 4.220 . 4.850 4.051 3.450 4.719 . 0 0 "[ . 1 . 2]" 1
1064 1 50 LYS HA 1 50 LYS HG2 4.190 . 4.820 2.595 2.408 3.762 . 0 0 "[ . 1 . 2]" 1
1065 1 50 LYS HA 1 50 LYS QG 3.560 . 4.090 2.445 2.302 3.348 . 0 0 "[ . 1 . 2]" 1
1066 1 50 LYS HA 1 50 LYS HG3 4.190 . 4.820 3.017 2.804 3.755 . 0 0 "[ . 1 . 2]" 1
1067 1 50 LYS HA 1 52 HIS H 4.930 . 5.670 3.486 3.260 3.779 . 0 0 "[ . 1 . 2]" 1
1068 1 50 LYS HA 1 55 ALA H 5.230 . 6.010 5.187 4.494 6.031 0.021 18 0 "[ . 1 . 2]" 1
1069 1 50 LYS HA 1 55 ALA MB 3.120 . 3.590 2.325 2.017 2.867 . 0 0 "[ . 1 . 2]" 1
1070 1 50 LYS HA 1 59 ILE MD 3.740 . 4.300 3.053 2.246 3.746 . 0 0 "[ . 1 . 2]" 1
1071 1 50 LYS HD2 1 59 ILE MD 5.500 . 6.330 4.755 3.577 5.830 . 0 0 "[ . 1 . 2]" 1
1072 1 50 LYS HD3 1 59 ILE MD 5.500 . 6.330 4.640 3.456 5.224 . 0 0 "[ . 1 . 2]" 1
1073 1 50 LYS QE 1 50 LYS QG 2.850 . 3.280 2.309 2.144 2.422 . 0 0 "[ . 1 . 2]" 1
1074 1 50 LYS QE 1 59 ILE MD 4.050 . 4.660 3.626 2.036 4.420 . 0 0 "[ . 1 . 2]" 1
1075 1 50 LYS HE2 1 50 LYS HG2 3.780 . 4.350 2.935 2.460 3.734 . 0 0 "[ . 1 . 2]" 1
1076 1 50 LYS HE2 1 50 LYS HG3 3.780 . 4.350 3.024 2.521 3.760 . 0 0 "[ . 1 . 2]" 1
1077 1 50 LYS HE3 1 50 LYS HG2 3.780 . 4.350 3.229 2.512 3.771 . 0 0 "[ . 1 . 2]" 1
1078 1 50 LYS HE3 1 50 LYS HG3 3.780 . 4.350 3.319 2.500 3.789 . 0 0 "[ . 1 . 2]" 1
1079 1 50 LYS QG 1 51 ARG H 5.340 . 6.140 4.227 2.467 4.503 . 0 0 "[ . 1 . 2]" 1
1080 1 50 LYS QG 1 59 ILE MD 3.710 . 4.270 2.627 1.891 4.294 0.024 5 0 "[ . 1 . 2]" 1
1081 1 51 ARG H 1 51 ARG HB2 3.720 . 4.280 3.065 2.166 3.681 . 0 0 "[ . 1 . 2]" 1
1082 1 51 ARG H 1 51 ARG QB 3.070 . 3.530 2.516 2.144 2.774 . 0 0 "[ . 1 . 2]" 1
1083 1 51 ARG H 1 51 ARG HB3 3.720 . 4.280 3.133 2.460 3.672 . 0 0 "[ . 1 . 2]" 1
1084 1 51 ARG H 1 51 ARG HD2 5.500 . 6.330 4.184 3.129 4.984 . 0 0 "[ . 1 . 2]" 1
1085 1 51 ARG H 1 51 ARG QD 4.740 . 5.450 3.828 3.049 4.341 . 0 0 "[ . 1 . 2]" 1
1086 1 51 ARG H 1 51 ARG HD3 5.500 . 6.330 4.588 4.092 4.964 . 0 0 "[ . 1 . 2]" 1
1087 1 51 ARG H 1 51 ARG QG 3.140 . 3.610 2.290 2.006 3.479 . 0 0 "[ . 1 . 2]" 1
1088 1 51 ARG H 1 52 HIS H 3.340 . 3.840 2.797 2.531 3.216 . 0 0 "[ . 1 . 2]" 1
1089 1 51 ARG H 1 59 ILE MD 5.500 . 6.330 5.787 5.037 6.351 0.021 6 0 "[ . 1 . 2]" 1
1090 1 51 ARG HA 1 51 ARG HD2 5.440 . 6.260 4.554 2.215 5.544 . 0 0 "[ . 1 . 2]" 1
1091 1 51 ARG HA 1 51 ARG QD 4.640 . 5.340 4.052 2.199 4.633 . 0 0 "[ . 1 . 2]" 1
1092 1 51 ARG HA 1 51 ARG HD3 5.440 . 6.260 4.723 2.787 5.555 . 0 0 "[ . 1 . 2]" 1
1093 1 51 ARG HA 1 51 ARG QG 3.700 . 4.260 2.967 2.094 3.375 . 0 0 "[ . 1 . 2]" 1
1094 1 51 ARG QB 1 51 ARG QD 3.260 . 3.750 2.333 2.100 2.897 . 0 0 "[ . 1 . 2]" 1
1095 1 52 HIS H 1 52 HIS HB2 3.790 . 4.360 2.510 2.322 2.654 . 0 0 "[ . 1 . 2]" 1
1096 1 52 HIS H 1 52 HIS QB 3.290 . 3.780 2.470 2.294 2.606 . 0 0 "[ . 1 . 2]" 1
1097 1 52 HIS H 1 52 HIS HB3 3.790 . 4.360 3.690 3.578 3.790 . 0 0 "[ . 1 . 2]" 1
1098 1 52 HIS H 1 55 ALA H 5.500 . 6.330 4.366 3.834 5.248 . 0 0 "[ . 1 . 2]" 1
1099 1 52 HIS H 1 55 ALA HA 5.500 . 6.330 4.899 4.148 5.595 . 0 0 "[ . 1 . 2]" 1
1100 1 52 HIS H 1 55 ALA MB 3.840 . 4.420 2.811 2.328 3.809 . 0 0 "[ . 1 . 2]" 1
1101 1 52 HIS HA 1 53 PRO HB3 4.910 . 5.650 5.032 4.893 5.162 . 0 0 "[ . 1 . 2]" 1
1102 1 52 HIS HA 1 53 PRO HD2 3.510 . 4.040 2.190 2.020 2.417 . 0 0 "[ . 1 . 2]" 1
1103 1 52 HIS HA 1 53 PRO QD 3.030 . 3.480 2.052 1.964 2.136 . 0 0 "[ . 1 . 2]" 1
1104 1 52 HIS HA 1 53 PRO HD3 3.510 . 4.040 2.504 2.379 2.696 . 0 0 "[ . 1 . 2]" 1
1105 1 52 HIS HA 1 53 PRO HG2 4.800 . 5.520 4.372 4.202 4.551 . 0 0 "[ . 1 . 2]" 1
1106 1 52 HIS QB 1 53 PRO QD 4.560 . 5.240 2.533 2.195 2.941 . 0 0 "[ . 1 . 2]" 1
1107 1 52 HIS QB 1 55 ALA H 3.890 . 4.470 3.088 2.277 3.835 . 0 0 "[ . 1 . 2]" 1
1108 1 52 HIS QB 1 55 ALA HA 3.950 . 4.540 3.492 2.780 4.061 . 0 0 "[ . 1 . 2]" 1
1109 1 52 HIS QB 1 55 ALA MB 3.700 . 4.260 2.689 1.958 3.658 . 0 0 "[ . 1 . 2]" 1
1110 1 52 HIS HB2 1 55 ALA H 4.570 . 5.260 3.353 2.356 4.159 . 0 0 "[ . 1 . 2]" 1
1111 1 52 HIS HB2 1 55 ALA HA 4.500 . 5.180 3.613 2.860 4.239 . 0 0 "[ . 1 . 2]" 1
1112 1 52 HIS HB2 1 55 ALA MB 4.500 . 5.180 2.745 1.969 3.796 . 0 0 "[ . 1 . 2]" 1
1113 1 52 HIS HB3 1 55 ALA H 4.570 . 5.260 3.671 2.588 4.655 . 0 0 "[ . 1 . 2]" 1
1114 1 52 HIS HB3 1 55 ALA HA 4.500 . 5.180 4.667 3.786 5.197 0.017 11 0 "[ . 1 . 2]" 1
1115 1 52 HIS HB3 1 55 ALA MB 4.500 . 5.180 3.959 3.139 4.788 . 0 0 "[ . 1 . 2]" 1
1116 1 53 PRO HA 1 55 ALA H 4.320 . 4.970 3.761 3.454 4.399 . 0 0 "[ . 1 . 2]" 1
1117 1 53 PRO QD 1 55 ALA MB 4.780 . 5.500 4.949 4.658 5.243 . 0 0 "[ . 1 . 2]" 1
1118 1 53 PRO HG2 1 54 ASP H 4.780 . 5.500 2.606 2.254 3.006 . 0 0 "[ . 1 . 2]" 1
1119 1 53 PRO HG2 1 54 ASP QB 4.940 . 5.680 4.059 3.528 4.539 . 0 0 "[ . 1 . 2]" 1
1120 1 53 PRO HG2 1 55 ALA H 4.960 . 5.700 5.103 4.849 5.603 . 0 0 "[ . 1 . 2]" 1
1121 1 53 PRO HG3 1 54 ASP H 4.790 . 5.510 4.089 3.834 4.429 . 0 0 "[ . 1 . 2]" 1
1122 1 54 ASP H 1 54 ASP HB2 4.000 . 4.600 2.801 2.421 3.627 . 0 0 "[ . 1 . 2]" 1
1123 1 54 ASP H 1 54 ASP QB 3.430 . 3.940 2.536 2.072 2.778 . 0 0 "[ . 1 . 2]" 1
1124 1 54 ASP H 1 54 ASP HB3 4.000 . 4.600 3.347 2.129 3.757 . 0 0 "[ . 1 . 2]" 1
1125 1 54 ASP HA 1 55 ALA H 3.440 . 3.960 3.177 2.503 3.432 . 0 0 "[ . 1 . 2]" 1
1126 1 54 ASP HA 1 56 THR H 4.330 . 4.980 4.296 3.459 4.990 0.010 19 0 "[ . 1 . 2]" 1
1127 1 54 ASP HA 1 57 SER H 4.580 . 5.270 3.787 3.413 4.726 . 0 0 "[ . 1 . 2]" 1
1128 1 54 ASP QB 1 55 ALA H 4.180 . 4.810 3.603 3.175 4.046 . 0 0 "[ . 1 . 2]" 1
1129 1 54 ASP QB 1 56 THR MG 5.340 . 6.140 4.857 4.270 5.841 . 0 0 "[ . 1 . 2]" 1
1130 1 54 ASP QB 1 57 SER H 5.100 . 5.870 4.488 4.053 5.873 0.003 18 0 "[ . 1 . 2]" 1
1131 1 54 ASP QB 1 58 LYS QG 4.490 . 5.160 3.483 2.121 5.196 0.036 12 0 "[ . 1 . 2]" 1
1132 1 54 ASP HB2 1 55 ALA H 4.750 . 5.460 3.910 3.272 4.662 . 0 0 "[ . 1 . 2]" 1
1133 1 54 ASP HB3 1 55 ALA H 4.750 . 5.460 4.356 3.289 4.532 . 0 0 "[ . 1 . 2]" 1
1134 1 55 ALA H 1 55 ALA MB 2.720 . 3.130 2.249 2.216 2.519 . 0 0 "[ . 1 . 2]" 1
1135 1 55 ALA H 1 56 THR H 3.610 . 4.150 2.931 1.980 3.336 . 0 0 "[ . 1 . 2]" 1
1136 1 55 ALA H 1 56 THR MG 4.590 . 5.280 3.896 2.924 4.434 . 0 0 "[ . 1 . 2]" 1
1137 1 55 ALA H 1 58 LYS H 5.500 . 6.330 4.977 4.655 5.434 . 0 0 "[ . 1 . 2]" 1
1138 1 55 ALA H 1 59 ILE MD 4.760 . 5.470 5.243 4.995 5.508 0.038 19 0 "[ . 1 . 2]" 1
1139 1 55 ALA HA 1 58 LYS H 4.280 . 4.920 3.524 3.101 4.054 . 0 0 "[ . 1 . 2]" 1
1140 1 55 ALA HA 1 58 LYS QB 4.200 . 4.830 3.029 2.382 3.737 . 0 0 "[ . 1 . 2]" 1
1141 1 55 ALA HA 1 58 LYS QG 4.590 . 5.280 3.905 2.812 4.908 . 0 0 "[ . 1 . 2]" 1
1142 1 55 ALA HA 1 59 ILE MD 4.460 . 5.130 3.844 3.108 4.344 . 0 0 "[ . 1 . 2]" 1
1143 1 55 ALA MB 1 56 THR H 2.970 . 3.420 2.337 1.943 2.642 . 0 0 "[ . 1 . 2]" 1
1144 1 55 ALA MB 1 56 THR HB 4.600 . 5.290 4.126 3.700 4.424 . 0 0 "[ . 1 . 2]" 1
1145 1 55 ALA MB 1 56 THR MG 4.410 . 5.070 3.848 3.425 4.081 . 0 0 "[ . 1 . 2]" 1
1146 1 55 ALA MB 1 57 SER H 4.570 . 5.260 4.437 3.967 4.765 . 0 0 "[ . 1 . 2]" 1
1147 1 55 ALA MB 1 59 ILE MD 3.040 . 3.500 2.409 2.164 2.909 . 0 0 "[ . 1 . 2]" 1
1148 1 56 THR H 1 56 THR HB 3.060 . 3.520 2.603 2.521 2.715 . 0 0 "[ . 1 . 2]" 1
1149 1 56 THR H 1 56 THR MG 3.410 . 3.920 2.075 1.903 2.179 . 0 0 "[ . 1 . 2]" 1
1150 1 56 THR H 1 57 SER H 3.410 . 3.920 2.901 2.650 3.084 . 0 0 "[ . 1 . 2]" 1
1151 1 56 THR H 1 59 ILE MD 4.370 . 5.030 4.070 3.425 4.638 . 0 0 "[ . 1 . 2]" 1
1152 1 56 THR HA 1 56 THR MG 3.290 . 3.780 3.219 3.201 3.227 . 0 0 "[ . 1 . 2]" 1
1153 1 56 THR HA 1 59 ILE H 4.170 . 4.800 3.588 3.132 3.964 . 0 0 "[ . 1 . 2]" 1
1154 1 56 THR HA 1 59 ILE HB 3.920 . 4.510 2.828 2.078 3.534 . 0 0 "[ . 1 . 2]" 1
1155 1 56 THR HA 1 59 ILE MD 4.090 . 4.700 3.068 2.070 3.965 . 0 0 "[ . 1 . 2]" 1
1156 1 56 THR HB 1 57 SER H 4.140 . 4.760 4.045 3.935 4.134 . 0 0 "[ . 1 . 2]" 1
1157 1 56 THR MG 1 57 SER H 3.760 . 4.320 2.131 1.841 2.447 . 0 0 "[ . 1 . 2]" 1
1158 1 56 THR MG 1 57 SER HA 4.300 . 4.950 3.433 3.271 3.630 . 0 0 "[ . 1 . 2]" 1
1159 1 56 THR MG 1 58 LYS H 4.500 . 5.180 4.294 4.017 4.725 . 0 0 "[ . 1 . 2]" 1
1160 1 56 THR MG 1 60 GLY H 5.140 . 5.910 5.164 4.628 5.592 . 0 0 "[ . 1 . 2]" 1
1161 1 57 SER H 1 57 SER HB2 3.530 . 4.060 2.795 2.447 3.638 . 0 0 "[ . 1 . 2]" 1
1162 1 57 SER H 1 57 SER QB 2.940 . 3.380 2.380 2.255 2.590 . 0 0 "[ . 1 . 2]" 1
1163 1 57 SER H 1 57 SER HB3 3.530 . 4.060 2.783 2.401 3.622 . 0 0 "[ . 1 . 2]" 1
1164 1 57 SER H 1 58 LYS H 3.430 . 3.940 2.582 2.309 2.783 . 0 0 "[ . 1 . 2]" 1
1165 1 57 SER H 1 59 ILE MD 5.050 . 5.810 5.390 4.841 5.826 0.016 16 0 "[ . 1 . 2]" 1
1166 1 57 SER H 1 60 GLY H 5.100 . 5.870 4.831 4.526 5.245 . 0 0 "[ . 1 . 2]" 1
1167 1 57 SER HA 1 59 ILE H 4.980 . 5.730 4.220 3.747 4.817 . 0 0 "[ . 1 . 2]" 1
1168 1 57 SER HA 1 60 GLY H 4.220 . 4.850 4.001 3.503 4.648 . 0 0 "[ . 1 . 2]" 1
1169 1 57 SER QB 1 58 LYS H 3.970 . 4.570 2.818 2.389 3.583 . 0 0 "[ . 1 . 2]" 1
1170 1 57 SER HB2 1 58 LYS H 4.580 . 5.270 3.676 2.543 4.202 . 0 0 "[ . 1 . 2]" 1
1171 1 57 SER HB3 1 58 LYS H 4.580 . 5.270 3.203 2.414 4.089 . 0 0 "[ . 1 . 2]" 1
1172 1 58 LYS H 1 58 LYS HG2 4.660 . 5.360 3.133 1.990 4.624 . 0 0 "[ . 1 . 2]" 1
1173 1 58 LYS H 1 58 LYS QG 3.990 . 4.590 2.585 1.980 4.053 . 0 0 "[ . 1 . 2]" 1
1174 1 58 LYS H 1 58 LYS HG3 4.660 . 5.360 3.308 2.355 4.482 . 0 0 "[ . 1 . 2]" 1
1175 1 58 LYS H 1 59 ILE H 3.760 . 4.320 2.443 2.152 2.783 . 0 0 "[ . 1 . 2]" 1
1176 1 58 LYS H 1 59 ILE MD 4.790 . 5.510 5.031 4.642 5.333 . 0 0 "[ . 1 . 2]" 1
1177 1 58 LYS H 1 60 GLY H 4.910 . 5.650 4.288 3.887 4.649 . 0 0 "[ . 1 . 2]" 1
1178 1 58 LYS HA 1 58 LYS HD2 4.390 . 5.050 3.622 2.202 4.717 . 0 0 "[ . 1 . 2]" 1
1179 1 58 LYS HA 1 58 LYS QD 3.760 . 4.320 2.937 1.873 4.032 . 0 0 "[ . 1 . 2]" 1
1180 1 58 LYS HA 1 58 LYS HD3 4.390 . 5.050 3.349 1.893 4.632 . 0 0 "[ . 1 . 2]" 1
1181 1 58 LYS HA 1 88 GLU QG 5.340 . 6.140 4.103 2.532 5.874 . 0 0 "[ . 1 . 2]" 1
1182 1 58 LYS QB 1 59 ILE H 3.880 . 4.460 3.079 2.461 3.628 . 0 0 "[ . 1 . 2]" 1
1183 1 58 LYS QB 1 80 ILE MD 3.410 . 3.920 2.426 1.851 3.570 . 0 0 "[ . 1 . 2]" 1
1184 1 58 LYS QD 1 80 ILE MD 4.030 . 4.630 3.190 2.150 4.550 . 0 0 "[ . 1 . 2]" 1
1185 1 58 LYS QD 1 88 GLU QB 4.830 . 5.550 3.599 2.083 5.164 . 0 0 "[ . 1 . 2]" 1
1186 1 58 LYS QD 1 88 GLU QG 4.140 . 4.760 3.043 1.775 4.791 0.031 9 0 "[ . 1 . 2]" 1
1187 1 59 ILE H 1 59 ILE HB 3.040 . 3.500 2.516 2.461 2.598 . 0 0 "[ . 1 . 2]" 1
1188 1 59 ILE H 1 59 ILE MD 4.580 . 5.270 3.769 3.542 4.013 . 0 0 "[ . 1 . 2]" 1
1189 1 59 ILE H 1 59 ILE QG 3.270 . 3.760 2.430 2.125 2.798 . 0 0 "[ . 1 . 2]" 1
1190 1 59 ILE H 1 59 ILE MG 4.090 . 4.700 3.803 3.773 3.849 . 0 0 "[ . 1 . 2]" 1
1191 1 59 ILE H 1 60 GLY H 3.540 . 4.070 2.460 2.137 2.692 . 0 0 "[ . 1 . 2]" 1
1192 1 59 ILE H 1 60 GLY HA2 4.870 . 5.600 4.655 4.307 4.962 . 0 0 "[ . 1 . 2]" 1
1193 1 59 ILE H 1 80 ILE MD 5.500 . 6.330 5.165 4.281 6.343 0.013 3 0 "[ . 1 . 2]" 1
1194 1 59 ILE HA 1 59 ILE MD 4.010 . 4.610 3.841 3.811 3.864 . 0 0 "[ . 1 . 2]" 1
1195 1 59 ILE HA 1 59 ILE HG12 3.620 . 4.160 2.533 2.471 2.577 . 0 0 "[ . 1 . 2]" 1
1196 1 59 ILE HA 1 59 ILE HG13 3.620 . 4.160 3.008 2.966 3.062 . 0 0 "[ . 1 . 2]" 1
1197 1 59 ILE HA 1 59 ILE MG 3.060 . 3.520 2.440 2.413 2.481 . 0 0 "[ . 1 . 2]" 1
1198 1 59 ILE HA 1 63 VAL MG1 5.500 . 6.330 5.117 4.589 5.951 . 0 0 "[ . 1 . 2]" 1
1199 1 59 ILE HA 1 63 VAL MG2 4.090 . 4.700 3.142 2.511 4.459 . 0 0 "[ . 1 . 2]" 1
1200 1 59 ILE HB 1 59 ILE MD 3.410 . 3.920 2.439 2.417 2.455 . 0 0 "[ . 1 . 2]" 1
1201 1 59 ILE HB 1 60 GLY H 3.570 . 4.110 2.448 2.066 2.659 . 0 0 "[ . 1 . 2]" 1
1202 1 59 ILE MD 1 60 GLY H 4.640 . 5.340 4.477 4.154 4.633 . 0 0 "[ . 1 . 2]" 1
1203 1 59 ILE QG 1 63 VAL MG2 4.550 . 5.230 2.883 2.212 4.063 . 0 0 "[ . 1 . 2]" 1
1204 1 59 ILE MG 1 60 GLY H 3.700 . 4.260 3.245 2.901 3.443 . 0 0 "[ . 1 . 2]" 1
1205 1 59 ILE MG 1 60 GLY HA2 5.130 . 5.900 4.322 4.070 4.509 . 0 0 "[ . 1 . 2]" 1
1206 1 59 ILE MG 1 60 GLY HA3 5.060 . 5.820 4.261 4.037 4.429 . 0 0 "[ . 1 . 2]" 1
1207 1 59 ILE MG 1 62 GLY H 3.250 . 3.740 3.075 2.579 3.422 . 0 0 "[ . 1 . 2]" 1
1208 1 59 ILE MG 1 62 GLY HA2 3.850 . 4.430 2.534 2.130 2.984 . 0 0 "[ . 1 . 2]" 1
1209 1 59 ILE MG 1 62 GLY QA 3.340 . 3.840 2.504 2.113 2.936 . 0 0 "[ . 1 . 2]" 1
1210 1 59 ILE MG 1 62 GLY HA3 3.850 . 4.430 3.925 3.528 4.364 . 0 0 "[ . 1 . 2]" 1
1211 1 59 ILE MG 1 63 VAL H 3.740 . 4.300 3.387 2.545 4.320 0.020 9 0 "[ . 1 . 2]" 1
1212 1 60 GLY H 1 61 PRO HD2 4.990 . 5.740 4.533 4.406 4.808 . 0 0 "[ . 1 . 2]" 1
1213 1 60 GLY H 1 61 PRO HD3 4.990 . 5.740 5.092 4.960 5.283 . 0 0 "[ . 1 . 2]" 1
1214 1 60 GLY HA3 1 61 PRO HG2 4.590 . 5.280 4.324 4.159 4.426 . 0 0 "[ . 1 . 2]" 1
1215 1 60 GLY HA3 1 62 GLY H 4.450 . 5.120 3.775 3.383 4.076 . 0 0 "[ . 1 . 2]" 1
1216 1 61 PRO QB 1 62 GLY H 4.020 . 4.620 3.391 2.912 3.768 . 0 0 "[ . 1 . 2]" 1
1217 1 61 PRO QD 1 62 GLY H 3.550 . 4.080 2.621 2.378 2.819 . 0 0 "[ . 1 . 2]" 1
1218 1 61 PRO QD 1 84 ASP H 4.180 . 4.810 3.677 2.925 4.062 . 0 0 "[ . 1 . 2]" 1
1219 1 61 PRO HD2 1 62 GLY H 4.080 . 4.690 2.666 2.407 2.880 . 0 0 "[ . 1 . 2]" 1
1220 1 61 PRO HD3 1 62 GLY H 4.080 . 4.690 3.879 3.719 4.015 . 0 0 "[ . 1 . 2]" 1
1221 1 61 PRO HG2 1 62 GLY H 3.680 . 4.230 2.610 2.060 3.361 . 0 0 "[ . 1 . 2]" 1
1222 1 61 PRO HG2 1 84 ASP H 3.870 . 4.450 2.723 2.286 3.527 . 0 0 "[ . 1 . 2]" 1
1223 1 61 PRO HG3 1 84 ASP H 4.230 . 4.860 3.190 2.308 4.115 . 0 0 "[ . 1 . 2]" 1
1224 1 61 PRO HG3 1 84 ASP HA 3.630 . 4.170 3.509 2.780 4.282 0.112 12 0 "[ . 1 . 2]" 1
1225 1 61 PRO HG3 1 84 ASP HB2 4.500 . 5.180 2.832 1.801 5.216 0.036 4 0 "[ . 1 . 2]" 1
1226 1 61 PRO HG3 1 84 ASP HB3 4.500 . 5.180 3.598 1.786 5.024 0.014 16 0 "[ . 1 . 2]" 1
1227 1 62 GLY H 1 63 VAL H 4.580 . 5.270 4.334 4.196 4.434 . 0 0 "[ . 1 . 2]" 1
1228 1 62 GLY H 1 83 THR H 4.420 . 5.080 3.900 3.524 4.616 . 0 0 "[ . 1 . 2]" 1
1229 1 62 GLY H 1 83 THR MG 4.630 . 5.320 4.156 3.878 4.572 . 0 0 "[ . 1 . 2]" 1
1230 1 62 GLY QA 1 63 VAL H 2.750 . 3.160 2.245 2.180 2.283 . 0 0 "[ . 1 . 2]" 1
1231 1 62 GLY QA 1 63 VAL HB 5.120 . 5.890 4.442 4.389 4.515 . 0 0 "[ . 1 . 2]" 1
1232 1 62 GLY QA 1 83 THR MG 3.750 . 4.310 2.954 2.577 3.405 . 0 0 "[ . 1 . 2]" 1
1233 1 62 GLY HA2 1 63 VAL H 3.150 . 3.620 2.395 2.251 2.538 . 0 0 "[ . 1 . 2]" 1
1234 1 62 GLY HA3 1 63 VAL H 3.150 . 3.620 2.751 2.589 2.934 . 0 0 "[ . 1 . 2]" 1
1235 1 63 VAL H 1 63 VAL HB 3.030 . 3.480 2.546 2.497 2.639 . 0 0 "[ . 1 . 2]" 1
1236 1 63 VAL H 1 63 VAL MG1 4.030 . 4.630 3.817 3.796 3.871 . 0 0 "[ . 1 . 2]" 1
1237 1 63 VAL H 1 63 VAL MG2 2.920 . 3.360 2.373 2.213 2.651 . 0 0 "[ . 1 . 2]" 1
1238 1 63 VAL H 1 64 ARG H 4.550 . 5.230 4.443 4.341 4.520 . 0 0 "[ . 1 . 2]" 1
1239 1 63 VAL H 1 82 ARG HA 5.500 . 6.330 5.284 4.739 5.968 . 0 0 "[ . 1 . 2]" 1
1240 1 63 VAL H 1 83 THR MG 4.090 . 4.700 3.738 3.047 4.273 . 0 0 "[ . 1 . 2]" 1
1241 1 63 VAL HA 1 63 VAL MG1 3.450 . 3.970 2.407 2.372 2.442 . 0 0 "[ . 1 . 2]" 1
1242 1 63 VAL HA 1 63 VAL MG2 3.230 . 3.710 2.415 2.390 2.464 . 0 0 "[ . 1 . 2]" 1
1243 1 63 VAL HA 1 64 ARG H 3.240 . 3.730 2.169 2.149 2.196 . 0 0 "[ . 1 . 2]" 1
1244 1 63 VAL HA 1 64 ARG HB2 5.260 . 6.050 4.509 4.294 4.932 . 0 0 "[ . 1 . 2]" 1
1245 1 63 VAL HA 1 64 ARG QB 4.560 . 5.240 4.097 4.028 4.219 . 0 0 "[ . 1 . 2]" 1
1246 1 63 VAL HA 1 64 ARG HB3 5.260 . 6.050 4.732 4.552 5.009 . 0 0 "[ . 1 . 2]" 1
1247 1 63 VAL HA 1 65 ASN H 4.390 . 5.050 4.270 4.043 4.593 . 0 0 "[ . 1 . 2]" 1
1248 1 63 VAL HA 1 82 ARG HA 3.600 . 4.140 2.847 1.938 3.689 . 0 0 "[ . 1 . 2]" 1
1249 1 63 VAL HA 1 83 THR H 4.140 . 4.760 3.629 2.732 4.444 . 0 0 "[ . 1 . 2]" 1
1250 1 63 VAL HA 1 83 THR MG 4.900 . 5.640 3.632 3.144 4.172 . 0 0 "[ . 1 . 2]" 1
1251 1 63 VAL HB 1 64 ARG H 4.460 . 5.130 4.261 4.155 4.371 . 0 0 "[ . 1 . 2]" 1
1252 1 63 VAL MG1 1 64 ARG H 3.750 . 4.310 2.838 2.635 3.056 . 0 0 "[ . 1 . 2]" 1
1253 1 63 VAL MG1 1 64 ARG HA 4.890 . 5.620 3.973 3.842 4.142 . 0 0 "[ . 1 . 2]" 1
1254 1 63 VAL MG1 1 65 ASN H 3.330 . 3.830 3.030 2.672 3.617 . 0 0 "[ . 1 . 2]" 1
1255 1 63 VAL MG1 1 65 ASN HA 4.190 . 4.820 3.131 2.738 3.501 . 0 0 "[ . 1 . 2]" 1
1256 1 63 VAL MG1 1 66 PHE HA 5.370 . 6.180 4.704 4.133 5.583 . 0 0 "[ . 1 . 2]" 1
1257 1 63 VAL MG1 1 66 PHE QE 3.590 . 4.130 2.356 2.004 2.664 . 0 0 "[ . 1 . 2]" 1
1258 1 63 VAL MG1 1 66 PHE HZ 3.600 . 4.140 3.042 2.617 3.622 . 0 0 "[ . 1 . 2]" 1
1259 1 63 VAL MG1 1 80 ILE HA 5.330 . 6.130 4.139 3.351 5.357 . 0 0 "[ . 1 . 2]" 1
1260 1 63 VAL MG1 1 80 ILE MG 3.800 . 4.370 2.828 1.993 4.233 . 0 0 "[ . 1 . 2]" 1
1261 1 63 VAL MG1 1 81 LEU H 4.830 . 5.550 4.046 3.498 5.088 . 0 0 "[ . 1 . 2]" 1
1262 1 63 VAL MG1 1 83 THR H 5.500 . 6.330 5.244 4.575 5.873 . 0 0 "[ . 1 . 2]" 1
1263 1 63 VAL MG2 1 64 ARG H 4.020 . 4.620 4.121 4.052 4.259 . 0 0 "[ . 1 . 2]" 1
1264 1 63 VAL MG2 1 65 ASN H 5.500 . 6.330 5.315 5.095 5.664 . 0 0 "[ . 1 . 2]" 1
1265 1 63 VAL MG2 1 66 PHE QE 4.240 . 4.880 3.743 3.165 4.283 . 0 0 "[ . 1 . 2]" 1
1266 1 63 VAL MG2 1 66 PHE HZ 3.880 . 4.460 3.470 2.908 4.134 . 0 0 "[ . 1 . 2]" 1
1267 1 63 VAL MG2 1 82 ARG HA 4.760 . 5.470 4.367 3.432 5.329 . 0 0 "[ . 1 . 2]" 1
1268 1 63 VAL MG2 1 83 THR H 5.500 . 6.330 5.197 4.403 5.957 . 0 0 "[ . 1 . 2]" 1
1269 1 64 ARG H 1 64 ARG HB2 3.920 . 4.510 2.604 2.394 2.931 . 0 0 "[ . 1 . 2]" 1
1270 1 64 ARG H 1 64 ARG QB 3.180 . 3.660 2.292 2.241 2.352 . 0 0 "[ . 1 . 2]" 1
1271 1 64 ARG H 1 64 ARG HB3 3.920 . 4.510 2.583 2.401 2.827 . 0 0 "[ . 1 . 2]" 1
1272 1 64 ARG H 1 64 ARG HD2 5.500 . 6.330 4.996 4.634 5.420 . 0 0 "[ . 1 . 2]" 1
1273 1 64 ARG H 1 64 ARG HD3 5.500 . 6.330 4.943 4.744 6.016 . 0 0 "[ . 1 . 2]" 1
1274 1 64 ARG H 1 64 ARG HG2 5.500 . 6.330 4.463 4.305 4.720 . 0 0 "[ . 1 . 2]" 1
1275 1 64 ARG H 1 64 ARG QG 4.740 . 5.450 4.021 3.966 4.111 . 0 0 "[ . 1 . 2]" 1
1276 1 64 ARG H 1 64 ARG HG3 5.500 . 6.330 4.577 4.443 4.690 . 0 0 "[ . 1 . 2]" 1
1277 1 64 ARG H 1 65 ASN H 3.170 . 3.650 2.574 2.365 2.742 . 0 0 "[ . 1 . 2]" 1
1278 1 64 ARG H 1 80 ILE MG 4.880 . 5.610 4.446 3.816 5.369 . 0 0 "[ . 1 . 2]" 1
1279 1 64 ARG H 1 82 ARG HA 3.640 . 4.190 2.703 2.265 3.128 . 0 0 "[ . 1 . 2]" 1
1280 1 64 ARG H 1 83 THR H 4.290 . 4.930 3.343 2.848 3.746 . 0 0 "[ . 1 . 2]" 1
1281 1 64 ARG H 1 83 THR MG 4.260 . 4.900 3.184 2.765 3.566 . 0 0 "[ . 1 . 2]" 1
1282 1 64 ARG HA 1 64 ARG HD2 5.500 . 6.330 3.965 2.059 4.707 . 0 0 "[ . 1 . 2]" 1
1283 1 64 ARG HA 1 64 ARG QD 4.630 . 5.320 3.354 2.031 4.267 . 0 0 "[ . 1 . 2]" 1
1284 1 64 ARG HA 1 64 ARG HD3 5.500 . 6.330 3.823 2.857 4.883 . 0 0 "[ . 1 . 2]" 1
1285 1 64 ARG HA 1 64 ARG HG2 4.040 . 4.650 2.931 2.349 3.810 . 0 0 "[ . 1 . 2]" 1
1286 1 64 ARG HA 1 64 ARG QG 3.490 . 4.010 2.500 2.321 2.998 . 0 0 "[ . 1 . 2]" 1
1287 1 64 ARG HA 1 64 ARG HG3 4.040 . 4.650 3.082 2.489 3.659 . 0 0 "[ . 1 . 2]" 1
1288 1 64 ARG HA 1 65 ASN HA 4.890 . 5.620 4.700 4.636 4.754 . 0 0 "[ . 1 . 2]" 1
1289 1 64 ARG HA 1 83 THR H 5.010 . 5.760 4.779 4.344 5.167 . 0 0 "[ . 1 . 2]" 1
1290 1 64 ARG HA 1 83 THR MG 3.800 . 4.370 2.810 2.499 3.267 . 0 0 "[ . 1 . 2]" 1
1291 1 64 ARG QB 1 64 ARG QD 3.280 . 3.770 2.229 2.112 2.370 . 0 0 "[ . 1 . 2]" 1
1292 1 64 ARG QB 1 65 ASN H 3.260 . 3.750 2.249 1.978 2.432 . 0 0 "[ . 1 . 2]" 1
1293 1 64 ARG QB 1 65 ASN QD 5.180 . 5.960 4.111 2.683 5.123 . 0 0 "[ . 1 . 2]" 1
1294 1 64 ARG QB 1 82 ARG HA 4.030 . 4.630 3.495 2.937 3.996 . 0 0 "[ . 1 . 2]" 1
1295 1 64 ARG QB 1 83 THR H 4.190 . 4.820 3.218 2.771 3.738 . 0 0 "[ . 1 . 2]" 1
1296 1 64 ARG QB 1 83 THR HA 3.830 . 4.400 2.444 2.100 2.942 . 0 0 "[ . 1 . 2]" 1
1297 1 64 ARG QB 1 83 THR MG 3.390 . 3.900 2.483 2.203 2.840 . 0 0 "[ . 1 . 2]" 1
1298 1 64 ARG HB2 1 65 ASN H 3.870 . 4.450 3.634 3.430 3.820 . 0 0 "[ . 1 . 2]" 1
1299 1 64 ARG HB2 1 83 THR H 4.830 . 5.550 3.308 2.819 3.896 . 0 0 "[ . 1 . 2]" 1
1300 1 64 ARG HB2 1 83 THR HA 4.520 . 5.200 2.469 2.118 2.976 . 0 0 "[ . 1 . 2]" 1
1301 1 64 ARG HB2 1 83 THR MG 4.000 . 4.600 2.513 2.221 2.888 . 0 0 "[ . 1 . 2]" 1
1302 1 64 ARG HB3 1 65 ASN H 3.870 . 4.450 2.271 1.989 2.461 . 0 0 "[ . 1 . 2]" 1
1303 1 64 ARG HB3 1 83 THR H 4.830 . 5.550 4.464 3.929 5.147 . 0 0 "[ . 1 . 2]" 1
1304 1 64 ARG HB3 1 83 THR HA 4.520 . 5.200 3.949 3.466 4.613 . 0 0 "[ . 1 . 2]" 1
1305 1 64 ARG HB3 1 83 THR MG 4.000 . 4.600 3.896 3.643 4.192 . 0 0 "[ . 1 . 2]" 1
1306 1 64 ARG QD 1 65 ASN QD 3.960 . 4.550 3.624 2.409 4.569 0.019 9 0 "[ . 1 . 2]" 1
1307 1 64 ARG QD 1 83 THR MG 4.210 . 4.840 3.841 1.850 4.862 0.022 5 0 "[ . 1 . 2]" 1
1308 1 64 ARG HD2 1 65 ASN H 5.500 . 6.330 4.533 3.503 5.466 . 0 0 "[ . 1 . 2]" 1
1309 1 64 ARG HD3 1 65 ASN H 5.500 . 6.330 4.307 3.549 5.539 . 0 0 "[ . 1 . 2]" 1
1310 1 64 ARG QG 1 65 ASN QD 5.180 . 5.960 3.822 1.710 5.862 0.090 4 0 "[ . 1 . 2]" 1
1311 1 64 ARG QG 1 83 THR H 5.340 . 6.140 5.059 4.244 5.813 . 0 0 "[ . 1 . 2]" 1
1312 1 64 ARG QG 1 83 THR MG 4.010 . 4.610 3.205 2.405 4.098 . 0 0 "[ . 1 . 2]" 1
1313 1 64 ARG HG2 1 83 THR MG 4.730 . 5.440 3.872 2.489 5.035 . 0 0 "[ . 1 . 2]" 1
1314 1 64 ARG HG3 1 83 THR MG 4.730 . 5.440 3.662 2.886 4.745 . 0 0 "[ . 1 . 2]" 1
1315 1 65 ASN H 1 65 ASN HB2 4.160 . 4.780 4.043 3.957 4.117 . 0 0 "[ . 1 . 2]" 1
1316 1 65 ASN H 1 65 ASN QD 4.740 . 5.450 3.906 3.161 4.661 . 0 0 "[ . 1 . 2]" 1
1317 1 65 ASN H 1 66 PHE H 4.540 . 5.220 4.372 4.355 4.389 . 0 0 "[ . 1 . 2]" 1
1318 1 65 ASN H 1 66 PHE QD 5.500 . 6.330 5.078 4.905 5.367 . 0 0 "[ . 1 . 2]" 1
1319 1 65 ASN H 1 66 PHE QE 5.500 . 6.330 5.661 5.409 5.995 . 0 0 "[ . 1 . 2]" 1
1320 1 65 ASN H 1 81 LEU H 4.060 . 4.670 3.592 3.262 4.269 . 0 0 "[ . 1 . 2]" 1
1321 1 65 ASN H 1 81 LEU HB2 3.310 . 3.810 2.507 2.150 3.004 . 0 0 "[ . 1 . 2]" 1
1322 1 65 ASN H 1 81 LEU HB3 4.050 . 4.660 3.385 3.072 3.853 . 0 0 "[ . 1 . 2]" 1
1323 1 65 ASN H 1 81 LEU MD1 5.500 . 6.330 5.076 4.902 5.409 . 0 0 "[ . 1 . 2]" 1
1324 1 65 ASN H 1 81 LEU MD2 5.040 . 5.800 4.257 3.776 4.813 . 0 0 "[ . 1 . 2]" 1
1325 1 65 ASN H 1 81 LEU HG 5.290 . 6.080 4.751 4.384 5.351 . 0 0 "[ . 1 . 2]" 1
1326 1 65 ASN H 1 82 ARG HA 4.430 . 5.090 4.576 4.291 4.913 . 0 0 "[ . 1 . 2]" 1
1327 1 65 ASN HA 1 66 PHE H 3.250 . 3.740 2.591 2.287 2.710 . 0 0 "[ . 1 . 2]" 1
1328 1 65 ASN HA 1 81 LEU HB2 4.630 . 5.320 4.460 4.289 4.790 . 0 0 "[ . 1 . 2]" 1
1329 1 65 ASN HB2 1 66 PHE H 3.520 . 4.050 2.120 1.900 2.740 . 0 0 "[ . 1 . 2]" 1
1330 1 65 ASN HB2 1 81 LEU HB3 5.500 . 6.330 5.751 5.155 6.195 . 0 0 "[ . 1 . 2]" 1
1331 1 65 ASN HB3 1 66 PHE H 3.820 . 4.390 3.593 3.437 3.916 . 0 0 "[ . 1 . 2]" 1
1332 1 65 ASN QD 1 66 PHE H 4.490 . 5.160 3.770 2.460 4.801 . 0 0 "[ . 1 . 2]" 1
1333 1 65 ASN QD 1 81 LEU HB2 4.380 . 5.040 3.350 2.357 4.307 . 0 0 "[ . 1 . 2]" 1
1334 1 65 ASN QD 1 81 LEU HB3 4.630 . 5.320 3.742 3.026 4.772 . 0 0 "[ . 1 . 2]" 1
1335 1 65 ASN QD 1 81 LEU MD1 5.060 . 5.820 4.162 3.399 5.309 . 0 0 "[ . 1 . 2]" 1
1336 1 65 ASN QD 1 81 LEU MD2 4.210 . 4.840 3.491 2.305 4.819 . 0 0 "[ . 1 . 2]" 1
1337 1 65 ASN QD 1 81 LEU HG 4.360 . 5.010 2.932 1.934 4.196 . 0 0 "[ . 1 . 2]" 1
1338 1 65 ASN HD21 1 66 PHE H 5.250 . 6.040 3.983 2.481 5.218 . 0 0 "[ . 1 . 2]" 1
1339 1 65 ASN HD21 1 81 LEU HB2 5.230 . 6.010 4.082 3.034 5.304 . 0 0 "[ . 1 . 2]" 1
1340 1 65 ASN HD22 1 66 PHE H 5.250 . 6.040 4.966 4.044 5.609 . 0 0 "[ . 1 . 2]" 1
1341 1 65 ASN HD22 1 81 LEU HB2 5.230 . 6.010 3.568 2.456 4.573 . 0 0 "[ . 1 . 2]" 1
1342 1 66 PHE H 1 66 PHE QD 3.700 . 4.260 2.836 2.490 3.079 . 0 0 "[ . 1 . 2]" 1
1343 1 66 PHE H 1 81 LEU H 5.140 . 5.910 4.866 4.719 5.188 . 0 0 "[ . 1 . 2]" 1
1344 1 66 PHE H 1 81 LEU HB2 4.540 . 5.220 4.629 4.140 5.065 . 0 0 "[ . 1 . 2]" 1
1345 1 66 PHE H 1 81 LEU MD2 5.500 . 6.330 4.187 3.775 4.962 . 0 0 "[ . 1 . 2]" 1
1346 1 66 PHE HA 1 66 PHE QD 3.730 . 4.290 3.051 2.916 3.105 . 0 0 "[ . 1 . 2]" 1
1347 1 66 PHE HA 1 67 GLU H 3.110 . 3.580 2.233 2.171 2.350 . 0 0 "[ . 1 . 2]" 1
1348 1 66 PHE HA 1 67 GLU QB 4.700 . 5.400 4.056 3.939 4.377 . 0 0 "[ . 1 . 2]" 1
1349 1 66 PHE HA 1 79 TRP H 5.320 . 6.120 4.553 4.184 4.883 . 0 0 "[ . 1 . 2]" 1
1350 1 66 PHE HA 1 80 ILE HA 4.100 . 4.720 3.164 2.732 3.996 . 0 0 "[ . 1 . 2]" 1
1351 1 66 PHE HA 1 81 LEU H 4.380 . 5.040 2.791 2.591 3.030 . 0 0 "[ . 1 . 2]" 1
1352 1 66 PHE HA 1 81 LEU HB2 4.550 . 5.230 3.804 2.906 4.253 . 0 0 "[ . 1 . 2]" 1
1353 1 66 PHE HA 1 81 LEU MD2 4.220 . 4.850 2.569 2.247 3.390 . 0 0 "[ . 1 . 2]" 1
1354 1 66 PHE HB2 1 67 GLU H 4.640 . 5.340 4.100 3.889 4.306 . 0 0 "[ . 1 . 2]" 1
1355 1 66 PHE HB3 1 67 GLU H 3.790 . 4.360 3.017 2.681 3.344 . 0 0 "[ . 1 . 2]" 1
1356 1 66 PHE HB3 1 67 GLU HA 5.210 . 5.990 4.487 4.314 4.678 . 0 0 "[ . 1 . 2]" 1
1357 1 66 PHE HB3 1 80 ILE HA 5.140 . 5.910 4.539 4.250 5.060 . 0 0 "[ . 1 . 2]" 1
1358 1 66 PHE QD 1 67 GLU H 3.990 . 4.590 3.977 3.718 4.261 . 0 0 "[ . 1 . 2]" 1
1359 1 66 PHE QD 1 80 ILE HA 4.620 . 5.310 3.081 2.759 3.380 . 0 0 "[ . 1 . 2]" 1
1360 1 66 PHE QD 1 81 LEU H 5.040 . 5.800 4.387 3.853 4.820 . 0 0 "[ . 1 . 2]" 1
1361 1 66 PHE QE 1 80 ILE HA 4.390 . 5.050 3.541 2.936 4.238 . 0 0 "[ . 1 . 2]" 1
1362 1 66 PHE QE 1 80 ILE MD 4.160 . 4.780 3.225 2.770 4.329 . 0 0 "[ . 1 . 2]" 1
1363 1 66 PHE QE 1 80 ILE QG 4.050 . 4.660 2.007 1.789 2.929 0.011 6 0 "[ . 1 . 2]" 1
1364 1 66 PHE QE 1 80 ILE MG 3.780 . 4.350 3.232 2.789 3.748 . 0 0 "[ . 1 . 2]" 1
1365 1 66 PHE HZ 1 80 ILE MD 4.920 . 5.660 4.333 3.956 5.626 . 0 0 "[ . 1 . 2]" 1
1366 1 67 GLU H 1 67 GLU QB 3.260 . 3.750 2.504 2.301 2.630 . 0 0 "[ . 1 . 2]" 1
1367 1 67 GLU H 1 68 VAL H 4.870 . 5.600 4.452 4.325 4.563 . 0 0 "[ . 1 . 2]" 1
1368 1 67 GLU H 1 68 VAL MG2 5.500 . 6.330 4.880 4.708 5.092 . 0 0 "[ . 1 . 2]" 1
1369 1 67 GLU H 1 79 TRP H 4.020 . 4.620 2.967 2.626 3.355 . 0 0 "[ . 1 . 2]" 1
1370 1 67 GLU H 1 79 TRP HA 5.110 . 5.880 4.641 4.371 4.855 . 0 0 "[ . 1 . 2]" 1
1371 1 67 GLU H 1 79 TRP HB2 3.990 . 4.590 2.992 2.495 3.500 . 0 0 "[ . 1 . 2]" 1
1372 1 67 GLU H 1 80 ILE HA 4.860 . 5.590 4.318 3.739 4.992 . 0 0 "[ . 1 . 2]" 1
1373 1 67 GLU H 1 81 LEU H 5.050 . 5.810 4.059 3.628 4.371 . 0 0 "[ . 1 . 2]" 1
1374 1 67 GLU H 1 81 LEU MD2 3.870 . 4.450 2.463 1.990 2.990 . 0 0 "[ . 1 . 2]" 1
1375 1 67 GLU HA 1 67 GLU QG 3.470 . 3.990 2.449 2.266 2.551 . 0 0 "[ . 1 . 2]" 1
1376 1 67 GLU HA 1 68 VAL H 3.440 . 3.960 2.229 2.169 2.286 . 0 0 "[ . 1 . 2]" 1
1377 1 67 GLU HA 1 79 TRP HB2 5.500 . 6.330 4.739 4.314 5.222 . 0 0 "[ . 1 . 2]" 1
1378 1 67 GLU HA 1 81 LEU MD2 5.460 . 6.280 3.897 3.702 4.151 . 0 0 "[ . 1 . 2]" 1
1379 1 67 GLU QB 1 79 TRP HB2 4.940 . 5.680 2.468 2.050 3.408 . 0 0 "[ . 1 . 2]" 1
1380 1 67 GLU QB 1 79 TRP HB3 5.340 . 6.140 3.593 3.068 4.258 . 0 0 "[ . 1 . 2]" 1
1381 1 67 GLU QB 1 81 LEU MD1 4.040 . 4.650 3.707 3.332 4.196 . 0 0 "[ . 1 . 2]" 1
1382 1 67 GLU QB 1 81 LEU HG 3.740 . 4.300 3.585 3.123 4.296 . 0 0 "[ . 1 . 2]" 1
1383 1 67 GLU HB2 1 81 LEU MD2 3.790 . 4.360 2.312 2.023 2.559 . 0 0 "[ . 1 . 2]" 1
1384 1 67 GLU HB3 1 81 LEU MD2 3.790 . 4.360 2.442 2.041 3.945 . 0 0 "[ . 1 . 2]" 1
1385 1 67 GLU QG 1 68 VAL H 3.930 . 4.520 2.607 2.113 3.826 . 0 0 "[ . 1 . 2]" 1
1386 1 67 GLU QG 1 81 LEU MD2 5.340 . 6.140 3.744 2.231 3.990 . 0 0 "[ . 1 . 2]" 1
1387 1 67 GLU HG2 1 68 VAL H 4.510 . 5.190 2.906 2.186 4.623 . 0 0 "[ . 1 . 2]" 1
1388 1 67 GLU HG3 1 68 VAL H 4.510 . 5.190 3.013 2.587 4.935 . 0 0 "[ . 1 . 2]" 1
1389 1 68 VAL H 1 68 VAL HB 3.590 . 4.130 2.515 2.473 2.584 . 0 0 "[ . 1 . 2]" 1
1390 1 68 VAL H 1 68 VAL MG1 4.240 . 4.880 3.808 3.786 3.843 . 0 0 "[ . 1 . 2]" 1
1391 1 68 VAL H 1 68 VAL MG2 3.620 . 4.160 2.450 2.304 2.612 . 0 0 "[ . 1 . 2]" 1
1392 1 68 VAL H 1 69 ARG H 4.800 . 5.520 4.388 4.139 4.596 . 0 0 "[ . 1 . 2]" 1
1393 1 68 VAL HA 1 68 VAL MG1 3.570 . 4.110 2.430 2.369 2.470 . 0 0 "[ . 1 . 2]" 1
1394 1 68 VAL HA 1 68 VAL MG2 3.480 . 4.000 2.376 2.331 2.447 . 0 0 "[ . 1 . 2]" 1
1395 1 68 VAL HA 1 69 ARG H 3.170 . 3.650 2.174 2.125 2.252 . 0 0 "[ . 1 . 2]" 1
1396 1 68 VAL HA 1 78 PHE HA 4.130 . 4.750 2.993 2.684 3.197 . 0 0 "[ . 1 . 2]" 1
1397 1 68 VAL HA 1 79 TRP H 5.350 . 6.150 3.535 3.018 3.921 . 0 0 "[ . 1 . 2]" 1
1398 1 68 VAL MG1 1 69 ARG H 3.480 . 4.000 2.908 2.249 3.350 . 0 0 "[ . 1 . 2]" 1
1399 1 68 VAL MG1 1 70 SER H 5.070 . 5.830 4.939 4.520 5.361 . 0 0 "[ . 1 . 2]" 1
1400 1 68 VAL MG1 1 76 GLN HA 4.750 . 5.460 4.213 3.691 4.761 . 0 0 "[ . 1 . 2]" 1
1401 1 68 VAL MG1 1 76 GLN HB2 3.880 . 4.460 3.465 2.217 4.034 . 0 0 "[ . 1 . 2]" 1
1402 1 68 VAL MG1 1 76 GLN QB 3.250 . 3.740 2.408 2.006 2.847 . 0 0 "[ . 1 . 2]" 1
1403 1 68 VAL MG1 1 76 GLN HB3 3.880 . 4.460 2.484 2.148 2.910 . 0 0 "[ . 1 . 2]" 1
1404 1 68 VAL MG1 1 76 GLN HE21 3.820 . 4.390 2.119 1.798 2.725 0.002 7 0 "[ . 1 . 2]" 1
1405 1 68 VAL MG1 1 76 GLN HE22 3.760 . 4.320 2.962 2.465 4.150 . 0 0 "[ . 1 . 2]" 1
1406 1 68 VAL MG1 1 76 GLN HG2 4.480 . 5.150 3.132 2.212 3.686 . 0 0 "[ . 1 . 2]" 1
1407 1 68 VAL MG1 1 76 GLN HG3 4.710 . 5.420 4.302 3.572 4.800 . 0 0 "[ . 1 . 2]" 1
1408 1 68 VAL MG1 1 77 CYS H 3.650 . 4.200 3.374 2.884 3.860 . 0 0 "[ . 1 . 2]" 1
1409 1 68 VAL MG2 1 69 ARG H 4.190 . 4.820 4.089 3.878 4.297 . 0 0 "[ . 1 . 2]" 1
1410 1 68 VAL MG2 1 76 GLN HE21 4.770 . 5.490 4.332 3.834 4.715 . 0 0 "[ . 1 . 2]" 1
1411 1 68 VAL MG2 1 76 GLN HE22 5.500 . 6.330 4.737 4.119 5.985 . 0 0 "[ . 1 . 2]" 1
1412 1 68 VAL MG2 1 76 GLN HG2 5.500 . 6.330 5.624 4.842 6.230 . 0 0 "[ . 1 . 2]" 1
1413 1 68 VAL MG2 1 78 PHE HA 4.290 . 4.930 3.515 3.190 3.889 . 0 0 "[ . 1 . 2]" 1
1414 1 68 VAL MG2 1 78 PHE HD1 3.500 . 4.030 2.830 2.565 3.246 . 0 0 "[ . 1 . 2]" 1
1415 1 68 VAL MG2 1 78 PHE HE1 3.610 . 4.150 2.849 2.475 3.568 . 0 0 "[ . 1 . 2]" 1
1416 1 68 VAL MG2 1 78 PHE HZ 5.220 . 6.000 4.401 4.016 5.004 . 0 0 "[ . 1 . 2]" 1
1417 1 69 ARG H 1 69 ARG HB2 4.130 . 4.750 2.970 2.717 3.294 . 0 0 "[ . 1 . 2]" 1
1418 1 69 ARG H 1 69 ARG QB 3.570 . 4.110 2.622 2.390 2.750 . 0 0 "[ . 1 . 2]" 1
1419 1 69 ARG H 1 69 ARG HB3 4.130 . 4.750 3.118 2.597 3.876 . 0 0 "[ . 1 . 2]" 1
1420 1 69 ARG H 1 69 ARG QG 4.660 . 5.360 3.838 2.981 4.223 . 0 0 "[ . 1 . 2]" 1
1421 1 69 ARG H 1 76 GLN HA 5.230 . 6.010 4.831 4.535 5.281 . 0 0 "[ . 1 . 2]" 1
1422 1 69 ARG H 1 77 CYS H 3.800 . 4.370 2.983 2.668 3.297 . 0 0 "[ . 1 . 2]" 1
1423 1 69 ARG H 1 78 PHE HA 4.560 . 5.240 3.945 3.662 4.190 . 0 0 "[ . 1 . 2]" 1
1424 1 69 ARG H 1 79 TRP H 5.000 . 5.750 4.138 3.683 4.661 . 0 0 "[ . 1 . 2]" 1
1425 1 69 ARG H 1 79 TRP HB2 5.180 . 5.960 4.718 4.299 5.290 . 0 0 "[ . 1 . 2]" 1
1426 1 69 ARG H 1 79 TRP HD1 4.190 . 4.820 2.638 2.225 3.426 . 0 0 "[ . 1 . 2]" 1
1427 1 69 ARG HA 1 79 TRP HE1 5.500 . 6.330 4.876 4.379 5.373 . 0 0 "[ . 1 . 2]" 1
1428 1 69 ARG QB 1 70 SER H 3.930 . 4.520 3.002 1.891 3.568 . 0 0 "[ . 1 . 2]" 1
1429 1 69 ARG QB 1 79 TRP HD1 4.530 . 5.210 2.631 2.224 3.122 . 0 0 "[ . 1 . 2]" 1
1430 1 69 ARG QB 1 79 TRP HE1 3.670 . 4.220 2.134 1.794 2.974 0.006 4 0 "[ . 1 . 2]" 1
1431 1 69 ARG HB2 1 79 TRP HE1 4.520 . 5.200 3.260 1.802 4.687 . 0 0 "[ . 1 . 2]" 1
1432 1 69 ARG HB3 1 79 TRP HE1 4.520 . 5.200 2.592 1.894 3.462 . 0 0 "[ . 1 . 2]" 1
1433 1 69 ARG QD 1 79 TRP HD1 4.790 . 5.510 4.231 3.646 4.975 . 0 0 "[ . 1 . 2]" 1
1434 1 69 ARG QD 1 79 TRP HE1 4.070 . 4.680 3.358 2.800 4.161 . 0 0 "[ . 1 . 2]" 1
1435 1 69 ARG QD 1 79 TRP HH2 5.340 . 6.140 4.592 3.800 6.130 . 0 0 "[ . 1 . 2]" 1
1436 1 69 ARG HD2 1 79 TRP HE1 4.730 . 5.440 3.882 2.828 5.274 . 0 0 "[ . 1 . 2]" 1
1437 1 69 ARG HD3 1 79 TRP HE1 4.730 . 5.440 4.309 3.084 5.452 0.012 7 0 "[ . 1 . 2]" 1
1438 1 69 ARG QG 1 70 SER H 3.910 . 4.500 2.638 1.777 3.973 0.023 7 0 "[ . 1 . 2]" 1
1439 1 70 SER H 1 70 SER HB2 3.830 . 4.400 3.266 2.450 3.666 . 0 0 "[ . 1 . 2]" 1
1440 1 70 SER H 1 70 SER QB 3.350 . 3.850 2.547 2.316 2.714 . 0 0 "[ . 1 . 2]" 1
1441 1 70 SER H 1 70 SER HB3 3.830 . 4.400 2.887 2.516 3.642 . 0 0 "[ . 1 . 2]" 1
1442 1 70 SER HA 1 71 ALA H 3.140 . 3.610 2.296 2.166 2.572 . 0 0 "[ . 1 . 2]" 1
1443 1 70 SER HA 1 71 ALA MB 4.050 . 4.660 3.945 3.868 4.073 . 0 0 "[ . 1 . 2]" 1
1444 1 70 SER HA 1 76 GLN HA 3.350 . 3.850 2.292 1.765 3.258 0.035 4 0 "[ . 1 . 2]" 1
1445 1 70 SER HA 1 76 GLN HG2 3.980 . 4.580 3.535 2.390 4.134 . 0 0 "[ . 1 . 2]" 1
1446 1 70 SER HA 1 76 GLN HG3 4.220 . 4.850 3.917 2.316 4.836 . 0 0 "[ . 1 . 2]" 1
1447 1 70 SER HA 1 77 CYS H 4.270 . 4.910 3.755 3.426 4.408 . 0 0 "[ . 1 . 2]" 1
1448 1 70 SER QB 1 71 ALA H 3.500 . 4.030 2.841 2.205 4.024 . 0 0 "[ . 1 . 2]" 1
1449 1 70 SER QB 1 71 ALA MB 4.900 . 5.640 4.524 4.279 5.167 . 0 0 "[ . 1 . 2]" 1
1450 1 70 SER QB 1 76 GLN HA 4.570 . 5.260 4.056 3.491 4.912 . 0 0 "[ . 1 . 2]" 1
1451 1 70 SER HB2 1 71 ALA H 4.310 . 4.960 3.213 2.223 4.563 . 0 0 "[ . 1 . 2]" 1
1452 1 70 SER HB2 1 76 GLN HA 5.310 . 6.110 4.645 3.811 5.879 . 0 0 "[ . 1 . 2]" 1
1453 1 70 SER HB3 1 71 ALA H 4.310 . 4.960 3.688 2.575 4.473 . 0 0 "[ . 1 . 2]" 1
1454 1 70 SER HB3 1 76 GLN HA 5.310 . 6.110 4.548 3.928 5.264 . 0 0 "[ . 1 . 2]" 1
1455 1 71 ALA H 1 71 ALA MB 3.440 . 3.960 2.489 2.217 2.667 . 0 0 "[ . 1 . 2]" 1
1456 1 71 ALA H 1 72 ASP H 4.590 . 5.280 2.954 2.148 4.476 . 0 0 "[ . 1 . 2]" 1
1457 1 71 ALA H 1 76 GLN HA 3.500 . 4.030 2.928 2.137 3.754 . 0 0 "[ . 1 . 2]" 1
1458 1 71 ALA H 1 76 GLN QB 5.270 . 6.060 4.891 4.213 5.656 . 0 0 "[ . 1 . 2]" 1
1459 1 71 ALA H 1 77 CYS H 4.890 . 5.620 4.436 2.995 5.112 . 0 0 "[ . 1 . 2]" 1
1460 1 71 ALA MB 1 72 ASP H 2.990 . 3.440 2.154 1.854 3.379 . 0 0 "[ . 1 . 2]" 1
1461 1 71 ALA MB 1 72 ASP HA 4.350 . 5.000 4.087 3.807 4.485 . 0 0 "[ . 1 . 2]" 1
1462 1 71 ALA MB 1 72 ASP QB . . 4.750 3.757 3.145 4.402 . 0 0 "[ . 1 . 2]" 1
1463 1 71 ALA MB 1 76 GLN HA 3.770 . 4.340 3.516 2.368 4.358 0.018 17 0 "[ . 1 . 2]" 1
1464 1 71 ALA MB 1 77 CYS H 4.460 . 5.130 3.744 3.224 4.134 . 0 0 "[ . 1 . 2]" 1
1465 1 71 ALA MB 1 77 CYS HB2 4.210 . 4.840 2.663 1.773 3.708 0.027 5 0 "[ . 1 . 2]" 1
1466 1 71 ALA MB 1 77 CYS HB3 4.210 . 4.840 3.182 1.807 4.384 . 0 0 "[ . 1 . 2]" 1
1467 1 72 ASP H 1 72 ASP QB 3.290 . 3.780 2.606 2.421 3.240 . 0 0 "[ . 1 . 2]" 1
1468 1 72 ASP H 1 73 TYR H 4.900 . 5.640 3.908 2.630 4.650 . 0 0 "[ . 1 . 2]" 1
1469 1 72 ASP H 1 76 GLN HA 5.290 . 6.080 5.133 4.091 6.164 0.084 8 0 "[ . 1 . 2]" 1
1470 1 72 ASP HA 1 73 TYR H 3.290 . 3.780 2.888 2.183 3.588 . 0 0 "[ . 1 . 2]" 1
1471 1 72 ASP HA 1 74 GLY H 5.470 . 6.290 4.647 3.017 6.272 . 0 0 "[ . 1 . 2]" 1
1472 1 72 ASP QB 1 73 TYR H 4.010 . 4.010 2.351 1.775 3.618 0.025 7 0 "[ . 1 . 2]" 1
1473 1 72 ASP QB 1 73 TYR QD 4.600 . 5.290 3.055 2.418 4.253 . 0 0 "[ . 1 . 2]" 1
1474 1 72 ASP QB 1 73 TYR QE . . 5.400 3.970 3.020 5.263 . 0 0 "[ . 1 . 2]" 1
1475 1 73 TYR H 1 73 TYR QD 4.550 . 5.230 2.760 1.916 3.634 . 0 0 "[ . 1 . 2]" 1
1476 1 73 TYR H 1 74 GLY H 4.180 . 4.810 3.048 2.477 4.130 . 0 0 "[ . 1 . 2]" 1
1477 1 73 TYR HA 1 73 TYR QD . . 3.660 2.806 2.094 3.152 . 0 0 "[ . 1 . 2]" 1
1478 1 73 TYR HB2 1 73 TYR QD 3.030 . 3.480 2.374 2.289 2.496 . 0 0 "[ . 1 . 2]" 1
1479 1 73 TYR HB2 1 75 THR MG 5.240 . 6.030 4.166 2.173 5.340 . 0 0 "[ . 1 . 2]" 1
1480 1 73 TYR HB3 1 73 TYR QD 2.920 . 3.360 2.473 2.343 2.712 . 0 0 "[ . 1 . 2]" 1
1481 1 73 TYR QD 1 74 GLY H 5.500 . 6.330 4.275 3.546 4.910 . 0 0 "[ . 1 . 2]" 1
1482 1 74 GLY H 1 75 THR H 3.540 . 4.070 2.621 1.971 3.276 . 0 0 "[ . 1 . 2]" 1
1483 1 74 GLY QA 1 75 THR HA 4.840 . 5.570 4.045 4.008 4.107 . 0 0 "[ . 1 . 2]" 1
1484 1 74 GLY QA 1 75 THR MG 4.850 . 5.580 3.748 3.581 4.031 . 0 0 "[ . 1 . 2]" 1
1485 1 75 THR H 1 75 THR HB 4.050 . 4.660 3.781 3.614 3.934 . 0 0 "[ . 1 . 2]" 1
1486 1 75 THR H 1 75 THR MG 3.230 . 3.710 2.677 2.131 3.171 . 0 0 "[ . 1 . 2]" 1
1487 1 75 THR H 1 76 GLN H 4.680 . 5.380 4.458 4.319 4.626 . 0 0 "[ . 1 . 2]" 1
1488 1 75 THR HA 1 75 THR MG 3.200 . 3.680 2.389 2.288 2.460 . 0 0 "[ . 1 . 2]" 1
1489 1 75 THR HA 1 76 GLN H 3.230 . 3.710 2.400 2.132 2.833 . 0 0 "[ . 1 . 2]" 1
1490 1 75 THR HB 1 76 GLN H 2.990 . 3.440 2.525 1.810 3.279 . 0 0 "[ . 1 . 2]" 1
1491 1 75 THR MG 1 76 GLN H 3.880 . 4.460 3.735 3.487 3.978 . 0 0 "[ . 1 . 2]" 1
1492 1 76 GLN H 1 76 GLN HB2 4.150 . 4.770 2.552 2.393 2.720 . 0 0 "[ . 1 . 2]" 1
1493 1 76 GLN H 1 76 GLN QB 3.580 . 4.120 2.508 2.359 2.664 . 0 0 "[ . 1 . 2]" 1
1494 1 76 GLN H 1 76 GLN HB3 4.150 . 4.770 3.697 3.573 3.809 . 0 0 "[ . 1 . 2]" 1
1495 1 76 GLN H 1 76 GLN HG2 4.850 . 5.580 4.015 3.429 4.343 . 0 0 "[ . 1 . 2]" 1
1496 1 76 GLN H 1 76 GLN HG3 4.050 . 4.660 2.853 2.047 3.572 . 0 0 "[ . 1 . 2]" 1
1497 1 76 GLN H 1 77 CYS H 4.780 . 5.500 4.518 4.425 4.644 . 0 0 "[ . 1 . 2]" 1
1498 1 76 GLN HA 1 76 GLN HG3 4.040 . 4.650 2.883 2.530 3.106 . 0 0 "[ . 1 . 2]" 1
1499 1 76 GLN HA 1 77 CYS H 3.250 . 3.740 2.465 2.260 2.711 . 0 0 "[ . 1 . 2]" 1
1500 1 76 GLN QB 1 76 GLN HE21 3.860 . 4.440 2.698 1.757 2.845 0.043 20 0 "[ . 1 . 2]" 1
1501 1 76 GLN QB 1 76 GLN HE22 4.000 . 4.600 3.587 3.290 3.656 . 0 0 "[ . 1 . 2]" 1
1502 1 76 GLN QB 1 77 CYS H 3.430 . 3.940 2.367 1.967 2.846 . 0 0 "[ . 1 . 2]" 1
1503 1 76 GLN HB2 1 77 CYS H 4.090 . 4.700 3.534 2.987 3.981 . 0 0 "[ . 1 . 2]" 1
1504 1 76 GLN HB3 1 77 CYS H 4.090 . 4.700 2.407 1.990 2.915 . 0 0 "[ . 1 . 2]" 1
1505 1 76 GLN HE22 1 76 GLN HG2 3.780 . 4.350 3.521 3.494 3.754 . 0 0 "[ . 1 . 2]" 1
1506 1 77 CYS HA 1 78 PHE HA 4.590 . 5.280 4.387 4.332 4.425 . 0 0 "[ . 1 . 2]" 1
1507 1 77 CYS HA 1 92 TYR QD 4.220 . 4.850 4.102 3.037 4.855 0.005 18 0 "[ . 1 . 2]" 1
1508 1 77 CYS HA 1 92 TYR QE 3.590 . 4.130 3.196 2.294 4.002 . 0 0 "[ . 1 . 2]" 1
1509 1 77 CYS QB 1 78 PHE H 3.820 . 4.390 2.954 2.383 3.585 . 0 0 "[ . 1 . 2]" 1
1510 1 77 CYS QB 1 79 TRP HD1 4.730 . 5.440 3.692 3.111 4.307 . 0 0 "[ . 1 . 2]" 1
1511 1 77 CYS QB 1 79 TRP HE1 4.700 . 5.400 3.059 2.449 3.980 . 0 0 "[ . 1 . 2]" 1
1512 1 77 CYS QB 1 89 ARG HA 5.340 . 6.140 5.056 3.693 6.094 . 0 0 "[ . 1 . 2]" 1
1513 1 77 CYS QB 1 89 ARG QB 4.150 . 4.770 3.417 2.374 4.550 . 0 0 "[ . 1 . 2]" 1
1514 1 77 CYS QB 1 92 TYR QD 5.340 . 6.140 4.801 3.415 5.714 . 0 0 "[ . 1 . 2]" 1
1515 1 77 CYS HB2 1 78 PHE H 4.350 . 5.000 3.747 2.583 4.061 . 0 0 "[ . 1 . 2]" 1
1516 1 77 CYS HB2 1 79 TRP HE1 5.450 . 6.270 3.728 2.486 5.211 . 0 0 "[ . 1 . 2]" 1
1517 1 77 CYS HB3 1 78 PHE H 4.350 . 5.000 3.306 2.413 4.080 . 0 0 "[ . 1 . 2]" 1
1518 1 77 CYS HB3 1 79 TRP HE1 5.450 . 6.270 3.859 2.467 5.145 . 0 0 "[ . 1 . 2]" 1
1519 1 78 PHE H 1 79 TRP H 5.500 . 6.330 4.461 4.345 4.582 . 0 0 "[ . 1 . 2]" 1
1520 1 78 PHE HA 1 78 PHE HD1 3.730 . 4.290 2.692 2.460 2.823 . 0 0 "[ . 1 . 2]" 1
1521 1 78 PHE HA 1 79 TRP H 3.560 . 4.090 2.161 2.122 2.213 . 0 0 "[ . 1 . 2]" 1
1522 1 78 PHE QB 1 78 PHE HD2 3.270 . 3.760 2.316 2.275 2.350 . 0 0 "[ . 1 . 2]" 1
1523 1 78 PHE HD1 1 79 TRP H 4.860 . 5.590 4.086 3.816 4.339 . 0 0 "[ . 1 . 2]" 1
1524 1 79 TRP H 1 79 TRP HB2 4.090 . 4.700 2.418 2.336 2.482 . 0 0 "[ . 1 . 2]" 1
1525 1 79 TRP H 1 79 TRP HD1 5.120 . 5.890 2.714 2.376 3.154 . 0 0 "[ . 1 . 2]" 1
1526 1 79 TRP HA 1 89 ARG HA 3.840 . 4.420 2.356 1.889 2.722 . 0 0 "[ . 1 . 2]" 1
1527 1 79 TRP HA 1 89 ARG QB 4.170 . 4.800 3.133 2.342 3.821 . 0 0 "[ . 1 . 2]" 1
1528 1 79 TRP HB3 1 79 TRP HE3 4.010 . 4.610 2.425 2.382 2.496 . 0 0 "[ . 1 . 2]" 1
1529 1 79 TRP HB3 1 79 TRP HZ3 5.430 . 6.240 4.840 4.804 4.899 . 0 0 "[ . 1 . 2]" 1
1530 1 79 TRP HB3 1 80 ILE H 4.910 . 5.650 3.219 3.003 3.402 . 0 0 "[ . 1 . 2]" 1
1531 1 79 TRP HB3 1 81 LEU MD2 3.930 . 4.520 2.944 2.456 3.473 . 0 0 "[ . 1 . 2]" 1
1532 1 79 TRP HB3 1 89 ARG HA 5.500 . 6.330 4.452 4.033 4.945 . 0 0 "[ . 1 . 2]" 1
1533 1 79 TRP HE1 1 89 ARG HB2 5.390 . 6.200 4.543 3.773 5.060 . 0 0 "[ . 1 . 2]" 1
1534 1 79 TRP HE1 1 89 ARG QB 4.580 . 5.270 3.808 3.264 4.353 . 0 0 "[ . 1 . 2]" 1
1535 1 79 TRP HE1 1 89 ARG HB3 5.390 . 6.200 4.164 3.376 5.687 . 0 0 "[ . 1 . 2]" 1
1536 1 79 TRP HE1 1 89 ARG QD 4.180 . 4.810 3.883 2.004 4.834 0.024 10 0 "[ . 1 . 2]" 1
1537 1 79 TRP HE3 1 81 LEU MD2 4.710 . 5.420 4.432 3.837 5.143 . 0 0 "[ . 1 . 2]" 1
1538 1 79 TRP HE3 1 87 GLU HA 5.050 . 5.810 4.605 3.896 5.023 . 0 0 "[ . 1 . 2]" 1
1539 1 79 TRP HE3 1 87 GLU HB2 4.530 . 5.210 2.545 2.065 3.128 . 0 0 "[ . 1 . 2]" 1
1540 1 79 TRP HE3 1 87 GLU HB3 4.110 . 4.730 4.147 3.511 4.731 0.001 9 0 "[ . 1 . 2]" 1
1541 1 79 TRP HE3 1 87 GLU HG2 5.270 . 6.060 3.648 2.488 5.135 . 0 0 "[ . 1 . 2]" 1
1542 1 79 TRP HE3 1 87 GLU QG 4.500 . 5.180 3.005 2.269 3.828 . 0 0 "[ . 1 . 2]" 1
1543 1 79 TRP HE3 1 87 GLU HG3 5.270 . 6.060 3.435 2.496 5.068 . 0 0 "[ . 1 . 2]" 1
1544 1 79 TRP HE3 1 88 GLU QB 5.340 . 6.140 5.045 4.529 5.658 . 0 0 "[ . 1 . 2]" 1
1545 1 79 TRP HE3 1 89 ARG H 4.870 . 5.600 4.481 3.492 5.000 . 0 0 "[ . 1 . 2]" 1
1546 1 79 TRP HE3 1 89 ARG HA 5.330 . 6.130 4.528 4.159 5.159 . 0 0 "[ . 1 . 2]" 1
1547 1 79 TRP HH2 1 89 ARG QD 4.660 . 5.360 3.314 2.531 5.076 . 0 0 "[ . 1 . 2]" 1
1548 1 79 TRP HH2 1 89 ARG QG 4.820 . 5.540 4.195 3.086 5.291 . 0 0 "[ . 1 . 2]" 1
1549 1 79 TRP HZ2 1 89 ARG QB 4.320 . 4.970 3.869 3.529 4.380 . 0 0 "[ . 1 . 2]" 1
1550 1 79 TRP HZ2 1 89 ARG HD2 4.560 . 5.240 3.472 2.483 4.904 . 0 0 "[ . 1 . 2]" 1
1551 1 79 TRP HZ2 1 89 ARG QD 3.960 . 4.550 2.831 2.455 3.242 . 0 0 "[ . 1 . 2]" 1
1552 1 79 TRP HZ2 1 89 ARG HD3 4.560 . 5.240 3.669 2.494 4.918 . 0 0 "[ . 1 . 2]" 1
1553 1 79 TRP HZ2 1 89 ARG QG 5.340 . 6.140 4.500 3.530 4.978 . 0 0 "[ . 1 . 2]" 1
1554 1 79 TRP HZ3 1 87 GLU HB2 3.970 . 4.570 4.152 2.982 4.595 0.025 14 0 "[ . 1 . 2]" 1
1555 1 79 TRP HZ3 1 87 GLU QG 3.310 . 3.810 3.045 2.476 3.831 0.021 2 0 "[ . 1 . 2]" 1
1556 1 79 TRP HZ3 1 88 GLU HA 3.900 . 4.490 3.735 2.634 4.510 0.020 13 0 "[ . 1 . 2]" 1
1557 1 79 TRP HZ3 1 89 ARG H 4.420 . 5.080 4.609 3.581 5.125 0.045 14 0 "[ . 1 . 2]" 1
1558 1 79 TRP HZ3 1 89 ARG QD 5.340 . 6.140 4.415 3.652 5.996 . 0 0 "[ . 1 . 2]" 1
1559 1 80 ILE H 1 80 ILE MD 4.320 . 4.970 3.617 3.449 3.747 . 0 0 "[ . 1 . 2]" 1
1560 1 80 ILE H 1 80 ILE HG12 4.990 . 5.740 3.481 3.365 3.639 . 0 0 "[ . 1 . 2]" 1
1561 1 80 ILE H 1 80 ILE QG 4.190 . 4.820 2.187 1.990 2.389 . 0 0 "[ . 1 . 2]" 1
1562 1 80 ILE H 1 80 ILE HG13 4.990 . 5.740 2.211 2.004 2.424 . 0 0 "[ . 1 . 2]" 1
1563 1 80 ILE H 1 89 ARG HA 5.490 . 6.310 2.946 2.524 3.455 . 0 0 "[ . 1 . 2]" 1
1564 1 80 ILE HA 1 80 ILE MD 4.220 . 4.850 3.885 3.814 3.935 . 0 0 "[ . 1 . 2]" 1
1565 1 80 ILE HA 1 80 ILE HG12 4.110 . 4.730 2.633 2.489 2.735 . 0 0 "[ . 1 . 2]" 1
1566 1 80 ILE HA 1 80 ILE QG 3.590 . 4.130 2.495 2.378 2.562 . 0 0 "[ . 1 . 2]" 1
1567 1 80 ILE HA 1 80 ILE HG13 4.110 . 4.730 3.093 3.020 3.142 . 0 0 "[ . 1 . 2]" 1
1568 1 80 ILE HA 1 80 ILE MG 3.530 . 4.060 2.371 2.327 2.443 . 0 0 "[ . 1 . 2]" 1
1569 1 80 ILE HA 1 81 LEU H 3.490 . 4.010 2.224 2.174 2.311 . 0 0 "[ . 1 . 2]" 1
1570 1 80 ILE HB 1 80 ILE MD 3.140 . 3.610 2.415 2.377 2.456 . 0 0 "[ . 1 . 2]" 1
1571 1 80 ILE HB 1 82 ARG H 5.250 . 6.040 5.211 4.455 5.915 . 0 0 "[ . 1 . 2]" 1
1572 1 80 ILE MD 1 88 GLU QB 4.310 . 4.960 3.128 2.299 4.529 . 0 0 "[ . 1 . 2]" 1
1573 1 80 ILE MD 1 90 PHE HA 5.000 . 5.750 4.759 4.082 5.391 . 0 0 "[ . 1 . 2]" 1
1574 1 80 ILE MD 1 90 PHE HB2 4.200 . 4.830 4.080 3.538 4.795 . 0 0 "[ . 1 . 2]" 1
1575 1 80 ILE MD 1 90 PHE HB3 3.870 . 4.450 2.820 2.062 3.595 . 0 0 "[ . 1 . 2]" 1
1576 1 80 ILE MD 1 90 PHE HD1 3.960 . 4.550 2.430 2.208 2.739 . 0 0 "[ . 1 . 2]" 1
1577 1 80 ILE MD 1 90 PHE HE1 4.310 . 4.960 3.378 2.806 4.207 . 0 0 "[ . 1 . 2]" 1
1578 1 80 ILE QG 1 90 PHE HB3 4.310 . 4.960 3.989 3.259 4.517 . 0 0 "[ . 1 . 2]" 1
1579 1 80 ILE QG 1 90 PHE HD1 4.290 . 4.930 2.278 1.948 2.594 . 0 0 "[ . 1 . 2]" 1
1580 1 80 ILE QG 1 90 PHE HE1 4.060 . 4.670 2.714 2.353 2.976 . 0 0 "[ . 1 . 2]" 1
1581 1 80 ILE HG12 1 90 PHE HD1 4.900 . 5.640 3.270 2.539 3.739 . 0 0 "[ . 1 . 2]" 1
1582 1 80 ILE HG13 1 90 PHE HD1 4.900 . 5.640 2.327 2.023 2.645 . 0 0 "[ . 1 . 2]" 1
1583 1 80 ILE MG 1 81 LEU H 3.870 . 4.450 3.244 3.029 3.569 . 0 0 "[ . 1 . 2]" 1
1584 1 80 ILE MG 1 82 ARG H 4.170 . 4.800 3.885 3.442 4.355 . 0 0 "[ . 1 . 2]" 1
1585 1 80 ILE MG 1 82 ARG HG2 3.680 . 4.230 3.065 2.280 3.930 . 0 0 "[ . 1 . 2]" 1
1586 1 80 ILE MG 1 82 ARG HG3 3.680 . 4.230 3.147 2.091 4.338 0.108 12 0 "[ . 1 . 2]" 1
1587 1 81 LEU H 1 81 LEU HB2 3.680 . 4.230 2.367 2.280 2.460 . 0 0 "[ . 1 . 2]" 1
1588 1 81 LEU H 1 81 LEU MD1 4.470 . 5.140 3.754 3.561 3.954 . 0 0 "[ . 1 . 2]" 1
1589 1 81 LEU H 1 81 LEU MD2 4.390 . 5.050 2.227 2.099 2.384 . 0 0 "[ . 1 . 2]" 1
1590 1 81 LEU H 1 81 LEU HG 4.330 . 4.980 4.080 4.031 4.185 . 0 0 "[ . 1 . 2]" 1
1591 1 81 LEU H 1 82 ARG H 4.510 . 5.190 4.357 4.140 4.520 . 0 0 "[ . 1 . 2]" 1
1592 1 81 LEU HA 1 81 LEU MD1 3.770 . 4.340 1.969 1.923 2.014 . 0 0 "[ . 1 . 2]" 1
1593 1 81 LEU HA 1 81 LEU MD2 3.470 . 3.990 2.744 2.458 2.968 . 0 0 "[ . 1 . 2]" 1
1594 1 81 LEU HA 1 82 ARG H 2.890 . 3.320 2.158 2.115 2.225 . 0 0 "[ . 1 . 2]" 1
1595 1 81 LEU HA 1 87 GLU HA 4.000 . 4.600 2.659 2.139 2.991 . 0 0 "[ . 1 . 2]" 1
1596 1 81 LEU HA 1 87 GLU QG 4.640 . 5.340 4.908 4.698 5.173 . 0 0 "[ . 1 . 2]" 1
1597 1 81 LEU HB2 1 81 LEU MD2 3.350 . 3.850 2.374 2.325 2.428 . 0 0 "[ . 1 . 2]" 1
1598 1 81 LEU HB2 1 82 ARG H 4.980 . 5.730 4.426 4.257 4.541 . 0 0 "[ . 1 . 2]" 1
1599 1 81 LEU HB3 1 82 ARG H 4.020 . 4.620 3.617 3.279 3.954 . 0 0 "[ . 1 . 2]" 1
1600 1 81 LEU MD1 1 82 ARG H 3.740 . 4.300 3.505 3.236 3.749 . 0 0 "[ . 1 . 2]" 1
1601 1 81 LEU MD1 1 87 GLU H 5.210 . 5.990 4.264 3.628 4.903 . 0 0 "[ . 1 . 2]" 1
1602 1 81 LEU MD1 1 87 GLU HB2 4.910 . 5.650 2.787 2.291 3.259 . 0 0 "[ . 1 . 2]" 1
1603 1 81 LEU MD1 1 87 GLU HB3 4.360 . 5.010 1.867 1.738 2.139 0.062 4 0 "[ . 1 . 2]" 1
1604 1 81 LEU MD1 1 87 GLU QG 3.690 . 4.240 3.336 2.958 3.526 . 0 0 "[ . 1 . 2]" 1
1605 1 81 LEU MD2 1 87 GLU HA 4.530 . 5.210 4.023 3.209 4.624 . 0 0 "[ . 1 . 2]" 1
1606 1 81 LEU MD2 1 87 GLU HB2 3.660 . 4.210 3.388 2.428 4.219 0.009 8 0 "[ . 1 . 2]" 1
1607 1 81 LEU MD2 1 87 GLU HB3 5.020 . 5.770 3.472 2.624 4.194 . 0 0 "[ . 1 . 2]" 1
1608 1 81 LEU MD2 1 87 GLU QG 4.710 . 5.420 4.479 3.405 5.197 . 0 0 "[ . 1 . 2]" 1
1609 1 81 LEU HG 1 87 GLU QG 5.340 . 6.140 6.032 5.499 6.262 0.122 17 0 "[ . 1 . 2]" 1
1610 1 82 ARG H 1 82 ARG HB2 3.800 . 4.370 2.452 2.308 2.566 . 0 0 "[ . 1 . 2]" 1
1611 1 82 ARG H 1 82 ARG QB 3.290 . 3.780 2.415 2.281 2.522 . 0 0 "[ . 1 . 2]" 1
1612 1 82 ARG H 1 82 ARG HB3 3.800 . 4.370 3.632 3.567 3.713 . 0 0 "[ . 1 . 2]" 1
1613 1 82 ARG H 1 82 ARG HD2 5.000 . 5.750 4.616 3.715 4.984 . 0 0 "[ . 1 . 2]" 1
1614 1 82 ARG H 1 82 ARG QD 4.290 . 4.930 3.859 1.986 4.337 . 0 0 "[ . 1 . 2]" 1
1615 1 82 ARG H 1 82 ARG HD3 5.000 . 5.750 4.272 1.994 4.900 . 0 0 "[ . 1 . 2]" 1
1616 1 82 ARG H 1 82 ARG QG 3.700 . 4.260 2.558 2.285 3.443 . 0 0 "[ . 1 . 2]" 1
1617 1 82 ARG H 1 83 THR H 4.650 . 5.350 4.612 4.548 4.673 . 0 0 "[ . 1 . 2]" 1
1618 1 82 ARG H 1 84 ASP H 5.270 . 6.060 5.005 4.792 5.398 . 0 0 "[ . 1 . 2]" 1
1619 1 82 ARG H 1 85 GLY H 4.770 . 5.490 4.143 3.785 4.730 . 0 0 "[ . 1 . 2]" 1
1620 1 82 ARG H 1 85 GLY HA2 5.500 . 6.330 5.181 4.371 5.986 . 0 0 "[ . 1 . 2]" 1
1621 1 82 ARG H 1 86 SER H 4.350 . 5.000 4.315 2.652 5.000 . 13 0 "[ . 1 . 2]" 1
1622 1 82 ARG H 1 87 GLU H 4.940 . 5.680 4.953 4.490 5.289 . 0 0 "[ . 1 . 2]" 1
1623 1 82 ARG H 1 87 GLU HA 3.690 . 4.240 3.051 2.545 3.581 . 0 0 "[ . 1 . 2]" 1
1624 1 82 ARG H 1 87 GLU HB2 4.870 . 5.600 5.120 4.531 5.634 0.034 10 0 "[ . 1 . 2]" 1
1625 1 82 ARG H 1 87 GLU HB3 4.030 . 4.630 4.369 3.741 4.681 0.051 7 0 "[ . 1 . 2]" 1
1626 1 82 ARG HA 1 83 THR H 3.240 . 3.730 2.290 2.227 2.361 . 0 0 "[ . 1 . 2]" 1
1627 1 82 ARG HA 1 83 THR MG 4.120 . 4.740 3.768 3.601 3.903 . 0 0 "[ . 1 . 2]" 1
1628 1 82 ARG HA 1 84 ASP H 4.470 . 5.140 3.967 3.736 4.473 . 0 0 "[ . 1 . 2]" 1
1629 1 82 ARG HA 1 86 SER H 5.500 . 6.330 5.826 4.541 6.394 0.064 13 0 "[ . 1 . 2]" 1
1630 1 82 ARG QB 1 82 ARG QD 3.260 . 3.750 2.357 2.124 2.629 . 0 0 "[ . 1 . 2]" 1
1631 1 82 ARG QB 1 83 THR H 3.270 . 3.760 2.729 2.551 2.891 . 0 0 "[ . 1 . 2]" 1
1632 1 82 ARG QB 1 84 ASP H 3.790 . 4.360 2.437 2.145 2.957 . 0 0 "[ . 1 . 2]" 1
1633 1 82 ARG QB 1 85 GLY H 4.800 . 5.520 3.041 2.477 3.475 . 0 0 "[ . 1 . 2]" 1
1634 1 82 ARG QB 1 86 SER H 3.700 . 4.260 3.132 2.259 3.821 . 0 0 "[ . 1 . 2]" 1
1635 1 82 ARG HB2 1 83 THR H 3.800 . 4.370 3.910 3.732 4.056 . 0 0 "[ . 1 . 2]" 1
1636 1 82 ARG HB2 1 86 SER H 4.370 . 5.030 3.199 2.273 3.954 . 0 0 "[ . 1 . 2]" 1
1637 1 82 ARG HB3 1 83 THR H 3.800 . 4.370 2.786 2.589 2.960 . 0 0 "[ . 1 . 2]" 1
1638 1 82 ARG HB3 1 86 SER H 4.370 . 5.030 4.517 3.851 5.068 0.038 14 0 "[ . 1 . 2]" 1
1639 1 83 THR H 1 83 THR HB 4.070 . 4.680 3.637 3.619 3.652 . 0 0 "[ . 1 . 2]" 1
1640 1 83 THR H 1 83 THR MG 3.050 . 3.510 2.173 2.073 2.244 . 0 0 "[ . 1 . 2]" 1
1641 1 83 THR H 1 84 ASP H 3.700 . 4.260 2.665 2.493 2.886 . 0 0 "[ . 1 . 2]" 1
1642 1 83 THR H 1 85 GLY H 4.670 . 5.370 4.299 4.042 4.682 . 0 0 "[ . 1 . 2]" 1
1643 1 83 THR HA 1 83 THR MG 3.120 . 3.590 2.363 2.333 2.397 . 0 0 "[ . 1 . 2]" 1
1644 1 83 THR MG 1 84 ASP H 4.220 . 4.850 4.020 3.878 4.159 . 0 0 "[ . 1 . 2]" 1
1645 1 84 ASP H 1 84 ASP QB 3.590 . 4.130 2.329 2.169 2.792 . 0 0 "[ . 1 . 2]" 1
1646 1 84 ASP H 1 85 GLY H 3.270 . 3.760 2.750 2.486 2.981 . 0 0 "[ . 1 . 2]" 1
1647 1 84 ASP H 1 85 GLY HA2 5.220 . 6.000 5.085 4.850 5.198 . 0 0 "[ . 1 . 2]" 1
1648 1 84 ASP H 1 86 SER H 4.180 . 4.810 4.349 3.619 4.856 0.046 20 0 "[ . 1 . 2]" 1
1649 1 86 SER H 1 86 SER HB2 3.930 . 4.520 2.923 2.486 3.851 . 0 0 "[ . 1 . 2]" 1
1650 1 86 SER H 1 86 SER QB 3.410 . 3.920 2.550 2.247 3.108 . 0 0 "[ . 1 . 2]" 1
1651 1 86 SER H 1 86 SER HB3 3.930 . 4.520 3.185 2.430 3.909 . 0 0 "[ . 1 . 2]" 1
1652 1 86 SER H 1 87 GLU H 4.690 . 5.390 4.548 4.262 4.661 . 0 0 "[ . 1 . 2]" 1
1653 1 86 SER HA 1 87 GLU H 3.040 . 3.500 2.338 2.161 2.635 . 0 0 "[ . 1 . 2]" 1
1654 1 86 SER HA 1 87 GLU QG 4.720 . 5.430 4.158 3.136 4.922 . 0 0 "[ . 1 . 2]" 1
1655 1 86 SER QB 1 87 GLU H 3.250 . 3.740 2.887 2.038 3.637 . 0 0 "[ . 1 . 2]" 1
1656 1 86 SER HB2 1 87 GLU H 4.080 . 4.690 3.541 2.050 4.405 . 0 0 "[ . 1 . 2]" 1
1657 1 86 SER HB3 1 87 GLU H 4.080 . 4.690 3.371 2.139 4.085 . 0 0 "[ . 1 . 2]" 1
1658 1 87 GLU H 1 87 GLU HB2 4.040 . 4.650 3.758 3.594 3.934 . 0 0 "[ . 1 . 2]" 1
1659 1 87 GLU H 1 87 GLU QG 3.110 . 3.580 2.548 1.786 3.183 0.014 6 0 "[ . 1 . 2]" 1
1660 1 88 GLU HA 1 88 GLU QG 3.620 . 4.160 2.724 2.280 3.061 . 0 0 "[ . 1 . 2]" 1
1661 1 88 GLU HA 1 89 ARG H 3.510 . 4.040 2.402 2.146 2.722 . 0 0 "[ . 1 . 2]" 1
1662 1 88 GLU QB 1 89 ARG H 4.380 . 5.040 3.181 1.923 3.699 . 0 0 "[ . 1 . 2]" 1
1663 1 88 GLU HB2 1 89 ARG H 5.110 . 5.880 3.919 3.162 4.495 . 0 0 "[ . 1 . 2]" 1
1664 1 88 GLU HB3 1 89 ARG H 5.110 . 5.880 3.437 1.938 4.126 . 0 0 "[ . 1 . 2]" 1
1665 1 88 GLU QG 1 89 ARG H 3.880 . 4.460 2.742 1.908 4.013 . 0 0 "[ . 1 . 2]" 1
1666 1 89 ARG H 1 89 ARG QB 3.690 . 4.240 2.951 2.234 3.161 . 0 0 "[ . 1 . 2]" 1
1667 1 89 ARG H 1 89 ARG QD 4.850 . 5.580 4.141 3.609 4.758 . 0 0 "[ . 1 . 2]" 1
1668 1 89 ARG H 1 89 ARG QG 3.830 . 4.400 2.299 1.852 3.981 . 0 0 "[ . 1 . 2]" 1
1669 1 89 ARG QB 1 89 ARG QD 2.990 . 3.440 2.274 2.136 2.412 . 0 0 "[ . 1 . 2]" 1
1670 1 90 PHE HA 1 90 PHE HD1 4.210 . 4.840 4.077 3.990 4.167 . 0 0 "[ . 1 . 2]" 1
1671 1 90 PHE HB2 1 90 PHE HE2 4.820 . 5.540 4.619 4.605 4.635 . 0 0 "[ . 1 . 2]" 1
1672 1 90 PHE HB3 1 90 PHE HE1 5.080 . 5.840 4.767 4.728 4.803 . 0 0 "[ . 1 . 2]" 1
1673 1 90 PHE HE2 1 92 TYR HA 3.760 . 4.320 3.583 2.942 4.397 0.077 7 0 "[ . 1 . 2]" 1
1674 1 90 PHE HZ 1 92 TYR HB2 5.500 . 6.330 5.380 4.682 6.350 0.020 9 0 "[ . 1 . 2]" 1
1675 1 90 PHE HZ 1 92 TYR HB3 5.500 . 6.330 4.267 3.715 4.958 . 0 0 "[ . 1 . 2]" 1
1676 1 91 SER QB 1 93 LYS QG 4.610 . 5.300 2.806 1.943 4.102 . 0 0 "[ . 1 . 2]" 1
1677 1 91 SER QB 1 94 LYS H 4.320 . 4.970 3.065 2.385 3.522 . 0 0 "[ . 1 . 2]" 1
1678 1 91 SER QB 1 94 LYS QB 3.730 . 4.290 2.758 2.171 3.664 . 0 0 "[ . 1 . 2]" 1
1679 1 91 SER QB 1 94 LYS QG 4.740 . 5.450 2.890 2.271 4.407 . 0 0 "[ . 1 . 2]" 1
1680 1 91 SER HB2 1 93 LYS H 5.500 . 6.330 4.468 3.131 5.122 . 0 0 "[ . 1 . 2]" 1
1681 1 91 SER HB2 1 94 LYS H 5.060 . 5.820 3.638 2.670 4.837 . 0 0 "[ . 1 . 2]" 1
1682 1 91 SER HB3 1 93 LYS H 5.500 . 6.330 3.991 3.262 5.174 . 0 0 "[ . 1 . 2]" 1
1683 1 91 SER HB3 1 94 LYS H 5.060 . 5.820 3.580 2.477 4.900 . 0 0 "[ . 1 . 2]" 1
1684 1 92 TYR QD 1 93 LYS H 5.290 . 6.080 3.224 2.900 3.462 . 0 0 "[ . 1 . 2]" 1
1685 1 92 TYR QD 1 93 LYS HA 3.960 . 4.550 3.513 3.070 3.891 . 0 0 "[ . 1 . 2]" 1
1686 1 92 TYR QE 1 93 LYS HA 4.890 . 5.620 4.344 3.640 4.914 . 0 0 "[ . 1 . 2]" 1
1687 1 93 LYS H 1 93 LYS HB2 3.960 . 4.550 3.613 3.566 3.676 . 0 0 "[ . 1 . 2]" 1
1688 1 93 LYS H 1 93 LYS QB 3.390 . 3.900 2.573 2.414 2.817 . 0 0 "[ . 1 . 2]" 1
1689 1 93 LYS H 1 93 LYS HB3 3.960 . 4.550 2.636 2.451 2.944 . 0 0 "[ . 1 . 2]" 1
1690 1 93 LYS H 1 93 LYS HG2 4.110 . 4.730 2.293 1.862 3.403 . 0 0 "[ . 1 . 2]" 1
1691 1 93 LYS H 1 93 LYS QG 3.600 . 4.140 2.071 1.778 2.456 0.022 17 0 "[ . 1 . 2]" 1
1692 1 93 LYS H 1 93 LYS HG3 4.110 . 4.730 3.053 1.784 3.680 0.016 17 0 "[ . 1 . 2]" 1
1693 1 93 LYS HA 1 95 CYS H 4.770 . 5.490 3.911 3.456 4.584 . 0 0 "[ . 1 . 2]" 1
1694 1 93 LYS HB2 1 94 LYS H 5.290 . 6.080 4.016 3.251 4.365 . 0 0 "[ . 1 . 2]" 1
1695 1 93 LYS HB3 1 94 LYS H 5.290 . 6.080 4.205 3.755 4.657 . 0 0 "[ . 1 . 2]" 1
1696 1 93 LYS QE 1 93 LYS QG 2.980 . 3.430 2.273 2.143 2.380 . 0 0 "[ . 1 . 2]" 1
1697 1 93 LYS QE 1 94 LYS QG 3.100 . 3.570 3.178 2.168 3.663 0.093 8 0 "[ . 1 . 2]" 1
1698 1 93 LYS HE2 1 93 LYS HG2 3.830 . 4.400 3.113 2.435 3.747 . 0 0 "[ . 1 . 2]" 1
1699 1 93 LYS HE2 1 93 LYS HG3 3.830 . 4.400 2.813 2.444 3.699 . 0 0 "[ . 1 . 2]" 1
1700 1 93 LYS HE3 1 93 LYS HG2 3.830 . 4.400 3.423 2.589 3.826 . 0 0 "[ . 1 . 2]" 1
1701 1 93 LYS HE3 1 93 LYS HG3 3.830 . 4.400 2.967 2.411 3.764 . 0 0 "[ . 1 . 2]" 1
1702 1 93 LYS QG 1 94 LYS QG 3.760 . 4.320 2.491 1.759 3.985 0.041 7 0 "[ . 1 . 2]" 1
1703 1 94 LYS H 1 94 LYS HB2 3.810 . 4.380 2.464 2.151 2.649 . 0 0 "[ . 1 . 2]" 1
1704 1 94 LYS H 1 94 LYS HB3 3.810 . 4.380 3.658 3.413 3.786 . 0 0 "[ . 1 . 2]" 1
1705 1 94 LYS H 1 94 LYS HG2 4.530 . 5.210 3.439 2.682 4.141 . 0 0 "[ . 1 . 2]" 1
1706 1 94 LYS H 1 94 LYS QG 3.900 . 4.490 2.796 2.447 3.786 . 0 0 "[ . 1 . 2]" 1
1707 1 94 LYS H 1 94 LYS HG3 4.530 . 5.210 3.359 2.486 4.383 . 0 0 "[ . 1 . 2]" 1
1708 1 94 LYS H 1 95 CYS H 3.540 . 4.070 2.924 2.190 3.904 . 0 0 "[ . 1 . 2]" 1
1709 1 94 LYS H 1 95 CYS QB 4.790 . 5.510 4.278 3.810 4.823 . 0 0 "[ . 1 . 2]" 1
1710 1 94 LYS HA 1 94 LYS HE2 5.500 . 6.330 4.439 2.858 5.197 . 0 0 "[ . 1 . 2]" 1
1711 1 94 LYS HA 1 94 LYS HE3 5.500 . 6.330 4.856 3.730 5.887 . 0 0 "[ . 1 . 2]" 1
1712 1 94 LYS HA 1 94 LYS HG2 3.750 . 4.310 2.753 2.325 3.629 . 0 0 "[ . 1 . 2]" 1
1713 1 94 LYS HA 1 94 LYS QG 3.260 . 3.750 2.598 2.259 3.054 . 0 0 "[ . 1 . 2]" 1
1714 1 94 LYS HA 1 94 LYS HG3 3.750 . 4.310 3.340 2.628 3.768 . 0 0 "[ . 1 . 2]" 1
1715 1 94 LYS QB 1 95 CYS H 3.900 . 4.490 3.641 2.948 3.921 . 0 0 "[ . 1 . 2]" 1
1716 1 94 LYS QB 1 95 CYS QB 5.080 . 5.840 4.591 3.960 5.243 . 0 0 "[ . 1 . 2]" 1
1717 1 94 LYS HB2 1 95 CYS H 4.580 . 5.270 4.011 3.062 4.594 . 0 0 "[ . 1 . 2]" 1
1718 1 94 LYS HB3 1 95 CYS H 4.580 . 5.270 4.263 3.842 4.471 . 0 0 "[ . 1 . 2]" 1
1719 1 95 CYS H 1 95 CYS QB 3.500 . 4.030 2.646 2.322 3.396 . 0 0 "[ . 1 . 2]" 1
1720 1 95 CYS H 1 96 VAL HA 4.500 . 5.180 4.818 4.192 5.295 0.115 19 0 "[ . 1 . 2]" 1
1721 1 95 CYS H 1 96 VAL HB 4.870 . 5.600 4.946 3.934 5.630 0.030 9 0 "[ . 1 . 2]" 1
1722 1 95 CYS H 1 96 VAL MG2 3.610 . 4.150 3.263 2.280 4.157 0.007 1 0 "[ . 1 . 2]" 1
1723 1 95 CYS H 1 97 LEU H 5.350 . 6.150 5.639 4.189 6.255 0.105 9 0 "[ . 1 . 2]" 1
1724 1 95 CYS HA 1 96 VAL MG2 4.950 . 5.690 4.312 3.642 4.811 . 0 0 "[ . 1 . 2]" 1
1725 1 96 VAL HA 1 96 VAL MG1 3.270 . 3.760 2.388 2.357 2.437 . 0 0 "[ . 1 . 2]" 1
1726 1 96 VAL HA 1 96 VAL MG2 3.410 . 3.920 2.445 2.399 2.506 . 0 0 "[ . 1 . 2]" 1
1727 1 96 VAL HB 1 97 LEU H 4.580 . 5.270 2.166 1.711 4.484 0.089 19 0 "[ . 1 . 2]" 1
1728 1 96 VAL HB 1 97 LEU QB 5.340 . 6.140 3.989 3.428 5.808 . 0 0 "[ . 1 . 2]" 1
1729 1 96 VAL MG1 1 97 LEU H 3.900 . 4.490 2.813 2.310 3.598 . 0 0 "[ . 1 . 2]" 1
1730 1 96 VAL MG1 1 97 LEU HG 4.440 . 5.110 3.502 2.073 4.923 . 0 0 "[ . 1 . 2]" 1
1731 1 96 VAL MG1 1 98 GLU H 5.270 . 6.060 5.387 3.649 5.930 . 0 0 "[ . 1 . 2]" 1
1732 1 96 VAL MG2 1 97 LEU H 4.540 . 5.220 3.613 3.448 4.318 . 0 0 "[ . 1 . 2]" 1
1733 1 97 LEU H 1 97 LEU HB2 4.170 . 4.800 2.998 2.648 3.548 . 0 0 "[ . 1 . 2]" 1
1734 1 97 LEU H 1 97 LEU QB 3.460 . 3.980 2.809 2.599 3.099 . 0 0 "[ . 1 . 2]" 1
1735 1 97 LEU H 1 97 LEU HB3 4.170 . 4.800 3.628 2.948 3.920 . 0 0 "[ . 1 . 2]" 1
1736 1 97 LEU H 1 97 LEU MD2 4.610 . 5.300 4.166 3.913 4.442 . 0 0 "[ . 1 . 2]" 1
1737 1 97 LEU H 1 98 GLU H 4.380 . 5.040 4.115 2.384 4.461 . 0 0 "[ . 1 . 2]" 1
1738 1 97 LEU H 1 98 GLU QG 5.340 . 6.140 5.367 3.215 6.244 0.104 8 0 "[ . 1 . 2]" 1
1739 1 97 LEU HA 1 97 LEU MD2 3.010 . 3.460 2.095 1.902 3.029 . 0 0 "[ . 1 . 2]" 1
1740 1 97 LEU HA 1 98 GLU H 3.510 . 4.040 2.497 2.165 3.582 . 0 0 "[ . 1 . 2]" 1
1741 1 97 LEU QB 1 97 LEU MD1 2.850 . 3.280 2.134 2.094 2.275 . 0 0 "[ . 1 . 2]" 1
1742 1 97 LEU QB 1 97 LEU MD2 3.010 . 3.460 2.338 2.254 2.467 . 0 0 "[ . 1 . 2]" 1
1743 1 97 LEU QB 1 98 GLU QB 4.180 . 4.810 4.408 3.531 4.849 0.039 6 0 "[ . 1 . 2]" 1
1744 1 97 LEU HB2 1 97 LEU MD1 3.370 . 3.880 2.500 2.235 3.213 . 0 0 "[ . 1 . 2]" 1
1745 1 97 LEU HB2 1 98 GLU H 4.120 . 4.740 3.862 3.106 4.488 . 0 0 "[ . 1 . 2]" 1
1746 1 97 LEU HB3 1 97 LEU MD1 3.370 . 3.880 2.390 2.254 2.526 . 0 0 "[ . 1 . 2]" 1
1747 1 97 LEU HB3 1 98 GLU H 4.120 . 4.740 2.794 1.790 4.330 0.010 17 0 "[ . 1 . 2]" 1
1748 1 97 LEU MD1 1 98 GLU H 4.140 . 4.760 3.906 1.769 4.820 0.060 4 0 "[ . 1 . 2]" 1
1749 1 97 LEU MD1 1 98 GLU HA 5.500 . 6.330 5.555 3.063 6.345 0.015 13 0 "[ . 1 . 2]" 1
1750 1 97 LEU MD1 1 98 GLU QB 5.340 . 6.140 5.100 2.362 6.168 0.028 20 0 "[ . 1 . 2]" 1
1751 1 97 LEU MD2 1 98 GLU H 4.250 . 4.890 2.885 1.786 3.247 0.014 12 0 "[ . 1 . 2]" 1
1752 1 97 LEU MD2 1 98 GLU HA 4.670 . 5.370 4.958 2.950 5.462 0.092 3 0 "[ . 1 . 2]" 1
1753 1 97 LEU MD2 1 98 GLU QB 4.560 . 5.240 4.285 2.558 5.090 . 0 0 "[ . 1 . 2]" 1
1754 1 98 GLU H 1 98 GLU HB2 3.920 . 4.510 2.819 2.210 3.928 . 0 0 "[ . 1 . 2]" 1
1755 1 98 GLU H 1 98 GLU QB 3.370 . 3.880 2.545 2.188 3.357 . 0 0 "[ . 1 . 2]" 1
1756 1 98 GLU H 1 98 GLU HB3 3.920 . 4.510 3.345 2.610 3.851 . 0 0 "[ . 1 . 2]" 1
1757 1 98 GLU H 1 98 GLU QG 3.880 . 4.460 2.885 1.810 4.299 . 0 0 "[ . 1 . 2]" 1
1758 1 98 GLU HA 1 98 GLU QG 3.620 . 4.160 2.614 2.332 3.456 . 0 0 "[ . 1 . 2]" 1
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